USER MOD reduce.3.24.130724 H: found=0, std=0, add=1075, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1075 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 72 LYS NZ :NH3+ 168:sc= 1.84 (180deg=1.02) USER MOD Set 1.2: A 117 ASN : amide:sc= -0.907! C(o=0.94!,f=-5.7!) USER MOD Set 2.1: A 107 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 111 ASN : amide:sc= 0.534 K(o=1.4,f=-7.8) USER MOD Set 2.3: A 114 LYS NZ :NH3+ 164:sc= 0.877 (180deg=-0.836!) USER MOD Set 3.1: A 74 GLN : amide:sc= 0.369 K(o=1.3,f=-9.1!) USER MOD Set 3.2: A 75 LYS NZ :NH3+ 174:sc= 0.894 (180deg=-0.52) USER MOD Set 4.1: A 26 SER OG : rot -126:sc= 1.26 USER MOD Set 4.2: A 70 GLN : amide:sc= 0.427 K(o=1.7,f=-4.8!) USER MOD Set 5.1: A 65 ASN : amide:sc= -1.05 K(o=-2.1,f=0) USER MOD Set 5.2: A 69 GLN : amide:sc= -1.05 K(o=-2.1,f=-0.99) USER MOD Set 6.1: A 23 SER OG : rot -65:sc= 0.685 USER MOD Set 6.2: A 27 LYS NZ :NH3+ 144:sc= -0.108 (180deg=-0.117) USER MOD Single : A 7 GLN : amide:sc= -0.654 K(o=-0.65,f=-0.054) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ -155:sc= 1.5 (180deg=0.0763) USER MOD Single : A 13 ASN : amide:sc= -1.85 K(o=-1.9,f=-1.2) USER MOD Single : A 14 THR OG1 : rot 2:sc= 0.607 USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 19 GLN : amide:sc= -4.63! K(o=-4.6!,f=-1.7) USER MOD Single : A 21 SER OG : rot 140:sc= 0.397 USER MOD Single : A 24 SER OG : rot 48:sc= 1.2 USER MOD Single : A 32 GLN : amide:sc= 1.69 K(o=1.7,f=-7.1!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ 179:sc= 0.942 (180deg=0.917) USER MOD Single : A 42 MET CE :methyl -132:sc= -0.284 (180deg=-1.1) USER MOD Single : A 44 LYS NZ :NH3+ 178:sc= 0.162 (180deg=-0.00522) USER MOD Single : A 46 TYR OH : rot -10:sc= -0.42 USER MOD Single : A 47 MET CE :methyl -161:sc= -1.98! (180deg=-3.46!) USER MOD Single : A 51 SER OG : rot 180:sc= -0.0374 USER MOD Single : A 53 ASN : amide:sc= -3.89! K(o=-3.9!,f=-0.33) USER MOD Single : A 54 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 LYS NZ :NH3+ -157:sc= 3.48 (180deg=0.794) USER MOD Single : A 62 TYR OH : rot 180:sc= -0.0669 USER MOD Single : A 64 MET CE :methyl -143:sc= -1.4 (180deg=-1.68) USER MOD Single : A 66 HIS : no HD1:sc= -0.0911 X(o=-0.091,f=-0.014) USER MOD Single : A 78 GLN : amide:sc= -0.262 K(o=-0.26,f=-5.4!) USER MOD Single : A 80 GLN : amide:sc= -0.867 K(o=-0.87,f=-1.9) USER MOD Single : A 82 SER OG : rot 96:sc= 1.18 USER MOD Single : A 85 LYS NZ :NH3+ -147:sc= -0.458 (180deg=-2.89!) USER MOD Single : A 95 ASN : amide:sc= -1.9 K(o=-1.9,f=-4.2!) USER MOD Single : A 96 GLN : amide:sc= -0.0102 K(o=-0.01,f=-0.74) USER MOD Single : A 103 LYS NZ :NH3+ 168:sc= 1.28 (180deg=1.2) USER MOD Single : A 104 LYS NZ :NH3+ -163:sc= 0.807 (180deg=0.537) USER MOD Single : A 105 LYS NZ :NH3+ -108:sc= 0.0894 (180deg=-0.748) USER MOD Single : A 120 SER OG : rot 180:sc= -0.0128 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 GLN : amide:sc= 0.995 K(o=1,f=-0.59) USER MOD Single : A 125 ASN : amide:sc= 1.19 K(o=1.2,f=-0.12) USER MOD Single : A 130 SER OG : rot 179:sc= 0.388 USER MOD ----------------------------------------------------------------- ATOM 87 N GLN A 7 16.917 -3.151 -1.959 1.00 0.00 N ATOM 88 CA GLN A 7 16.193 -4.407 -2.104 1.00 0.00 C ATOM 89 C GLN A 7 16.769 -5.212 -3.268 1.00 0.00 C ATOM 90 O GLN A 7 16.828 -6.441 -3.216 1.00 0.00 O ATOM 91 CB GLN A 7 14.703 -4.120 -2.328 1.00 0.00 C ATOM 92 CG GLN A 7 14.452 -3.181 -3.513 1.00 0.00 C ATOM 93 CD GLN A 7 12.970 -2.884 -3.733 1.00 0.00 C ATOM 94 OE1 GLN A 7 12.554 -2.650 -4.861 1.00 0.00 O ATOM 95 NE2 GLN A 7 12.164 -2.888 -2.673 1.00 0.00 N ATOM 0 HA GLN A 7 16.303 -4.996 -1.193 1.00 0.00 H new ATOM 0 HB2 GLN A 7 14.178 -5.060 -2.497 1.00 0.00 H new ATOM 0 HB3 GLN A 7 14.283 -3.678 -1.425 1.00 0.00 H new ATOM 0 HG2 GLN A 7 14.984 -2.244 -3.347 1.00 0.00 H new ATOM 0 HG3 GLN A 7 14.866 -3.627 -4.417 1.00 0.00 H new ATOM 0 HE21 GLN A 7 12.541 -3.087 -1.746 1.00 0.00 H new ATOM 0 HE22 GLN A 7 11.170 -2.692 -2.788 1.00 0.00 H new ATOM 104 N PHE A 8 17.195 -4.514 -4.324 1.00 0.00 N ATOM 105 CA PHE A 8 17.778 -5.155 -5.485 1.00 0.00 C ATOM 106 C PHE A 8 19.136 -5.733 -5.099 1.00 0.00 C ATOM 107 O PHE A 8 19.431 -6.886 -5.405 1.00 0.00 O ATOM 108 CB PHE A 8 17.898 -4.110 -6.601 1.00 0.00 C ATOM 109 CG PHE A 8 17.829 -4.654 -8.007 1.00 0.00 C ATOM 110 CD1 PHE A 8 17.197 -3.894 -8.999 1.00 0.00 C ATOM 111 CD2 PHE A 8 18.382 -5.899 -8.337 1.00 0.00 C ATOM 112 CE1 PHE A 8 17.081 -4.387 -10.301 1.00 0.00 C ATOM 113 CE2 PHE A 8 18.293 -6.381 -9.647 1.00 0.00 C ATOM 114 CZ PHE A 8 17.630 -5.634 -10.632 1.00 0.00 C ATOM 0 H PHE A 8 17.142 -3.497 -4.390 1.00 0.00 H new ATOM 0 HA PHE A 8 17.155 -5.974 -5.844 1.00 0.00 H new ATOM 0 HB2 PHE A 8 17.103 -3.375 -6.474 1.00 0.00 H new ATOM 0 HB3 PHE A 8 18.843 -3.581 -6.480 1.00 0.00 H new ATOM 0 HD1 PHE A 8 16.797 -2.921 -8.756 1.00 0.00 H new ATOM 0 HD2 PHE A 8 18.878 -6.487 -7.579 1.00 0.00 H new ATOM 0 HE1 PHE A 8 16.568 -3.807 -11.054 1.00 0.00 H new ATOM 0 HE2 PHE A 8 18.737 -7.332 -9.901 1.00 0.00 H new ATOM 0 HZ PHE A 8 17.543 -6.017 -11.638 1.00 0.00 H new ATOM 124 N THR A 9 19.959 -4.925 -4.425 1.00 0.00 N ATOM 125 CA THR A 9 21.300 -5.315 -4.042 1.00 0.00 C ATOM 126 C THR A 9 21.260 -6.514 -3.108 1.00 0.00 C ATOM 127 O THR A 9 21.996 -7.468 -3.326 1.00 0.00 O ATOM 128 CB THR A 9 22.005 -4.135 -3.378 1.00 0.00 C ATOM 129 OG1 THR A 9 22.004 -3.025 -4.242 1.00 0.00 O ATOM 130 CG2 THR A 9 23.441 -4.491 -3.007 1.00 0.00 C ATOM 0 H THR A 9 19.704 -3.981 -4.133 1.00 0.00 H new ATOM 0 HA THR A 9 21.857 -5.603 -4.933 1.00 0.00 H new ATOM 0 HB THR A 9 21.463 -3.889 -2.465 1.00 0.00 H new ATOM 0 HG1 THR A 9 22.457 -2.272 -3.808 1.00 0.00 H new ATOM 0 HG21 THR A 9 23.919 -3.632 -2.536 1.00 0.00 H new ATOM 0 HG22 THR A 9 23.440 -5.331 -2.313 1.00 0.00 H new ATOM 0 HG23 THR A 9 23.992 -4.764 -3.907 1.00 0.00 H new ATOM 138 N THR A 10 20.412 -6.484 -2.073 1.00 0.00 N ATOM 139 CA THR A 10 20.357 -7.604 -1.146 1.00 0.00 C ATOM 140 C THR A 10 19.923 -8.858 -1.898 1.00 0.00 C ATOM 141 O THR A 10 20.278 -9.972 -1.512 1.00 0.00 O ATOM 142 CB THR A 10 19.456 -7.294 0.054 1.00 0.00 C ATOM 143 OG1 THR A 10 19.544 -8.353 0.976 1.00 0.00 O ATOM 144 CG2 THR A 10 17.992 -7.156 -0.347 1.00 0.00 C ATOM 0 H THR A 10 19.774 -5.716 -1.865 1.00 0.00 H new ATOM 0 HA THR A 10 21.350 -7.782 -0.733 1.00 0.00 H new ATOM 0 HB THR A 10 19.794 -6.350 0.481 1.00 0.00 H new ATOM 0 HG1 THR A 10 18.972 -8.163 1.748 1.00 0.00 H new ATOM 0 HG21 THR A 10 17.392 -6.937 0.536 1.00 0.00 H new ATOM 0 HG22 THR A 10 17.887 -6.345 -1.068 1.00 0.00 H new ATOM 0 HG23 THR A 10 17.649 -8.088 -0.797 1.00 0.00 H new ATOM 152 N LYS A 11 19.152 -8.682 -2.978 1.00 0.00 N ATOM 153 CA LYS A 11 18.846 -9.788 -3.863 1.00 0.00 C ATOM 154 C LYS A 11 20.129 -10.330 -4.491 1.00 0.00 C ATOM 155 O LYS A 11 20.399 -11.524 -4.408 1.00 0.00 O ATOM 156 CB LYS A 11 17.834 -9.333 -4.919 1.00 0.00 C ATOM 157 CG LYS A 11 16.731 -10.383 -5.065 1.00 0.00 C ATOM 158 CD LYS A 11 15.855 -10.399 -3.808 1.00 0.00 C ATOM 159 CE LYS A 11 14.593 -9.547 -3.984 1.00 0.00 C ATOM 160 NZ LYS A 11 14.906 -8.130 -4.241 1.00 0.00 N1+ ATOM 0 H LYS A 11 18.737 -7.790 -3.249 1.00 0.00 H new ATOM 0 HA LYS A 11 18.395 -10.603 -3.297 1.00 0.00 H new ATOM 0 HB2 LYS A 11 17.401 -8.375 -4.632 1.00 0.00 H new ATOM 0 HB3 LYS A 11 18.335 -9.183 -5.875 1.00 0.00 H new ATOM 0 HG2 LYS A 11 16.121 -10.162 -5.941 1.00 0.00 H new ATOM 0 HG3 LYS A 11 17.172 -11.367 -5.223 1.00 0.00 H new ATOM 0 HD2 LYS A 11 15.571 -11.425 -3.575 1.00 0.00 H new ATOM 0 HD3 LYS A 11 16.429 -10.027 -2.960 1.00 0.00 H new ATOM 0 HE2 LYS A 11 14.003 -9.942 -4.811 1.00 0.00 H new ATOM 0 HE3 LYS A 11 13.977 -9.624 -3.088 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 14.106 -7.538 -3.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 15.756 -7.860 -3.707 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 15.077 -7.991 -5.257 1.00 0.00 H new ATOM 174 N LEU A 12 20.932 -9.464 -5.123 1.00 0.00 N ATOM 175 CA LEU A 12 22.186 -9.867 -5.748 1.00 0.00 C ATOM 176 C LEU A 12 23.198 -10.368 -4.720 1.00 0.00 C ATOM 177 O LEU A 12 24.139 -11.074 -5.077 1.00 0.00 O ATOM 178 CB LEU A 12 22.768 -8.677 -6.506 1.00 0.00 C ATOM 179 CG LEU A 12 21.867 -8.313 -7.687 1.00 0.00 C ATOM 180 CD1 LEU A 12 21.697 -6.800 -7.754 1.00 0.00 C ATOM 181 CD2 LEU A 12 22.478 -8.801 -8.988 1.00 0.00 C ATOM 0 H LEU A 12 20.726 -8.469 -5.212 1.00 0.00 H new ATOM 0 HA LEU A 12 21.978 -10.690 -6.432 1.00 0.00 H new ATOM 0 HB2 LEU A 12 22.866 -7.822 -5.837 1.00 0.00 H new ATOM 0 HB3 LEU A 12 23.769 -8.918 -6.863 1.00 0.00 H new ATOM 0 HG LEU A 12 20.897 -8.790 -7.545 1.00 0.00 H new ATOM 0 HD11 LEU A 12 21.055 -6.543 -8.596 1.00 0.00 H new ATOM 0 HD12 LEU A 12 21.243 -6.444 -6.829 1.00 0.00 H new ATOM 0 HD13 LEU A 12 22.672 -6.330 -7.884 1.00 0.00 H new ATOM 0 HD21 LEU A 12 21.825 -8.534 -9.819 1.00 0.00 H new ATOM 0 HD22 LEU A 12 23.453 -8.335 -9.129 1.00 0.00 H new ATOM 0 HD23 LEU A 12 22.595 -9.884 -8.951 1.00 0.00 H new ATOM 193 N ASN A 13 23.011 -10.009 -3.447 1.00 0.00 N ATOM 194 CA ASN A 13 23.852 -10.505 -2.368 1.00 0.00 C ATOM 195 C ASN A 13 23.475 -11.943 -2.012 1.00 0.00 C ATOM 196 O ASN A 13 24.193 -12.583 -1.250 1.00 0.00 O ATOM 197 CB ASN A 13 23.724 -9.598 -1.136 1.00 0.00 C ATOM 198 CG ASN A 13 24.069 -8.136 -1.407 1.00 0.00 C ATOM 199 OD1 ASN A 13 23.830 -7.282 -0.559 1.00 0.00 O ATOM 200 ND2 ASN A 13 24.631 -7.825 -2.575 1.00 0.00 N ATOM 0 H ASN A 13 22.276 -9.371 -3.142 1.00 0.00 H new ATOM 0 HA ASN A 13 24.889 -10.495 -2.704 1.00 0.00 H new ATOM 0 HB2 ASN A 13 22.703 -9.656 -0.758 1.00 0.00 H new ATOM 0 HB3 ASN A 13 24.377 -9.976 -0.349 1.00 0.00 H new ATOM 0 HD21 ASN A 13 24.874 -6.856 -2.782 1.00 0.00 H new ATOM 0 HD22 ASN A 13 24.818 -8.556 -3.261 1.00 0.00 H new ATOM 207 N THR A 14 22.361 -12.452 -2.556 1.00 0.00 N ATOM 208 CA THR A 14 21.860 -13.781 -2.231 1.00 0.00 C ATOM 209 C THR A 14 21.554 -14.629 -3.467 1.00 0.00 C ATOM 210 O THR A 14 21.218 -15.801 -3.322 1.00 0.00 O ATOM 211 CB THR A 14 20.627 -13.660 -1.333 1.00 0.00 C ATOM 212 OG1 THR A 14 19.650 -12.845 -1.940 1.00 0.00 O ATOM 213 CG2 THR A 14 20.989 -13.073 0.030 1.00 0.00 C ATOM 0 H THR A 14 21.787 -11.949 -3.233 1.00 0.00 H new ATOM 0 HA THR A 14 22.654 -14.305 -1.698 1.00 0.00 H new ATOM 0 HB THR A 14 20.229 -14.665 -1.191 1.00 0.00 H new ATOM 0 HG1 THR A 14 19.967 -12.556 -2.821 1.00 0.00 H new ATOM 0 HG21 THR A 14 20.092 -13.000 0.645 1.00 0.00 H new ATOM 0 HG22 THR A 14 21.715 -13.719 0.523 1.00 0.00 H new ATOM 0 HG23 THR A 14 21.419 -12.080 -0.104 1.00 0.00 H new ATOM 221 N LEU A 15 21.666 -14.069 -4.676 1.00 0.00 N ATOM 222 CA LEU A 15 21.504 -14.851 -5.893 1.00 0.00 C ATOM 223 C LEU A 15 22.659 -15.831 -6.094 1.00 0.00 C ATOM 224 O LEU A 15 23.753 -15.646 -5.564 1.00 0.00 O ATOM 225 CB LEU A 15 21.354 -13.937 -7.116 1.00 0.00 C ATOM 226 CG LEU A 15 19.962 -13.304 -7.151 1.00 0.00 C ATOM 227 CD1 LEU A 15 19.923 -12.219 -8.225 1.00 0.00 C ATOM 228 CD2 LEU A 15 18.912 -14.364 -7.472 1.00 0.00 C ATOM 0 H LEU A 15 21.867 -13.081 -4.831 1.00 0.00 H new ATOM 0 HA LEU A 15 20.590 -15.435 -5.783 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.114 -13.156 -7.088 1.00 0.00 H new ATOM 0 HB3 LEU A 15 21.521 -14.511 -8.028 1.00 0.00 H new ATOM 0 HG LEU A 15 19.747 -12.868 -6.175 1.00 0.00 H new ATOM 0 HD11 LEU A 15 18.931 -11.768 -8.250 1.00 0.00 H new ATOM 0 HD12 LEU A 15 20.664 -11.453 -7.996 1.00 0.00 H new ATOM 0 HD13 LEU A 15 20.146 -12.660 -9.196 1.00 0.00 H new ATOM 0 HD21 LEU A 15 17.925 -13.903 -7.494 1.00 0.00 H new ATOM 0 HD22 LEU A 15 19.128 -14.807 -8.444 1.00 0.00 H new ATOM 0 HD23 LEU A 15 18.933 -15.140 -6.707 1.00 0.00 H new ATOM 240 N GLU A 16 22.387 -16.880 -6.875 1.00 0.00 N ATOM 241 CA GLU A 16 23.368 -17.865 -7.296 1.00 0.00 C ATOM 242 C GLU A 16 23.360 -17.919 -8.823 1.00 0.00 C ATOM 243 O GLU A 16 22.384 -17.504 -9.448 1.00 0.00 O ATOM 244 CB GLU A 16 23.051 -19.245 -6.705 1.00 0.00 C ATOM 245 CG GLU A 16 23.019 -19.213 -5.175 1.00 0.00 C ATOM 246 CD GLU A 16 22.924 -20.619 -4.585 1.00 0.00 C ATOM 247 OE1 GLU A 16 22.263 -21.481 -5.212 1.00 0.00 O ATOM 248 OE2 GLU A 16 23.518 -20.835 -3.506 1.00 0.00 O1- ATOM 0 H GLU A 16 21.452 -17.066 -7.238 1.00 0.00 H new ATOM 0 HA GLU A 16 24.356 -17.579 -6.935 1.00 0.00 H new ATOM 0 HB2 GLU A 16 22.088 -19.590 -7.082 1.00 0.00 H new ATOM 0 HB3 GLU A 16 23.799 -19.964 -7.038 1.00 0.00 H new ATOM 0 HG2 GLU A 16 23.917 -18.721 -4.802 1.00 0.00 H new ATOM 0 HG3 GLU A 16 22.168 -18.619 -4.841 1.00 0.00 H new ATOM 255 N ASP A 17 24.438 -18.425 -9.426 1.00 0.00 N ATOM 256 CA ASP A 17 24.588 -18.494 -10.873 1.00 0.00 C ATOM 257 C ASP A 17 23.631 -19.507 -11.519 1.00 0.00 C ATOM 258 O ASP A 17 23.915 -20.026 -12.598 1.00 0.00 O ATOM 259 CB ASP A 17 26.036 -18.824 -11.250 1.00 0.00 C ATOM 260 CG ASP A 17 27.044 -17.852 -10.647 1.00 0.00 C ATOM 261 OD1 ASP A 17 27.232 -17.874 -9.411 1.00 0.00 O ATOM 262 OD2 ASP A 17 27.627 -17.084 -11.444 1.00 0.00 O1- ATOM 0 H ASP A 17 25.237 -18.801 -8.915 1.00 0.00 H new ATOM 0 HA ASP A 17 24.327 -17.510 -11.262 1.00 0.00 H new ATOM 0 HB2 ASP A 17 26.271 -19.835 -10.918 1.00 0.00 H new ATOM 0 HB3 ASP A 17 26.134 -18.814 -12.336 1.00 0.00 H new ATOM 267 N SER A 18 22.500 -19.796 -10.869 1.00 0.00 N ATOM 268 CA SER A 18 21.590 -20.855 -11.271 1.00 0.00 C ATOM 269 C SER A 18 20.242 -20.292 -11.696 1.00 0.00 C ATOM 270 O SER A 18 19.727 -19.364 -11.076 1.00 0.00 O ATOM 271 CB SER A 18 21.391 -21.793 -10.091 1.00 0.00 C ATOM 272 OG SER A 18 22.625 -22.369 -9.727 1.00 0.00 O ATOM 0 H SER A 18 22.193 -19.290 -10.038 1.00 0.00 H new ATOM 0 HA SER A 18 22.019 -21.385 -12.121 1.00 0.00 H new ATOM 0 HB2 SER A 18 20.971 -21.246 -9.247 1.00 0.00 H new ATOM 0 HB3 SER A 18 20.677 -22.574 -10.352 1.00 0.00 H new ATOM 0 HG SER A 18 22.493 -22.971 -8.965 1.00 0.00 H new ATOM 278 N GLN A 19 19.668 -20.858 -12.760 1.00 0.00 N ATOM 279 CA GLN A 19 18.440 -20.361 -13.355 1.00 0.00 C ATOM 280 C GLN A 19 17.289 -20.287 -12.363 1.00 0.00 C ATOM 281 O GLN A 19 16.437 -19.415 -12.512 1.00 0.00 O ATOM 282 CB GLN A 19 18.118 -21.228 -14.570 1.00 0.00 C ATOM 283 CG GLN A 19 17.669 -22.638 -14.185 1.00 0.00 C ATOM 284 CD GLN A 19 16.180 -22.724 -13.869 1.00 0.00 C ATOM 285 OE1 GLN A 19 15.689 -23.779 -13.477 1.00 0.00 O ATOM 286 NE2 GLN A 19 15.448 -21.623 -14.033 1.00 0.00 N ATOM 0 H GLN A 19 20.050 -21.678 -13.231 1.00 0.00 H new ATOM 0 HA GLN A 19 18.586 -19.329 -13.674 1.00 0.00 H new ATOM 0 HB2 GLN A 19 17.334 -20.749 -15.156 1.00 0.00 H new ATOM 0 HB3 GLN A 19 18.999 -21.293 -15.209 1.00 0.00 H new ATOM 0 HG2 GLN A 19 17.902 -23.323 -15.001 1.00 0.00 H new ATOM 0 HG3 GLN A 19 18.239 -22.970 -13.317 1.00 0.00 H new ATOM 0 HE21 GLN A 19 15.887 -20.763 -14.360 1.00 0.00 H new ATOM 0 HE22 GLN A 19 14.448 -21.640 -13.831 1.00 0.00 H new ATOM 295 N GLU A 20 17.228 -21.166 -11.359 1.00 0.00 N ATOM 296 CA GLU A 20 16.119 -21.085 -10.417 1.00 0.00 C ATOM 297 C GLU A 20 16.284 -19.881 -9.498 1.00 0.00 C ATOM 298 O GLU A 20 15.326 -19.152 -9.247 1.00 0.00 O ATOM 299 CB GLU A 20 15.984 -22.376 -9.616 1.00 0.00 C ATOM 300 CG GLU A 20 14.770 -22.303 -8.678 1.00 0.00 C ATOM 301 CD GLU A 20 13.509 -21.782 -9.374 1.00 0.00 C ATOM 302 OE1 GLU A 20 13.287 -22.173 -10.541 1.00 0.00 O ATOM 303 OE2 GLU A 20 12.774 -20.996 -8.736 1.00 0.00 O1- ATOM 0 H GLU A 20 17.904 -21.910 -11.184 1.00 0.00 H new ATOM 0 HA GLU A 20 15.198 -20.953 -10.985 1.00 0.00 H new ATOM 0 HB2 GLU A 20 15.876 -23.222 -10.295 1.00 0.00 H new ATOM 0 HB3 GLU A 20 16.890 -22.547 -9.035 1.00 0.00 H new ATOM 0 HG2 GLU A 20 14.571 -23.295 -8.272 1.00 0.00 H new ATOM 0 HG3 GLU A 20 15.007 -21.655 -7.835 1.00 0.00 H new ATOM 310 N SER A 21 17.499 -19.669 -8.993 1.00 0.00 N ATOM 311 CA SER A 21 17.789 -18.519 -8.154 1.00 0.00 C ATOM 312 C SER A 21 17.626 -17.235 -8.969 1.00 0.00 C ATOM 313 O SER A 21 16.954 -16.296 -8.541 1.00 0.00 O ATOM 314 CB SER A 21 19.209 -18.654 -7.606 1.00 0.00 C ATOM 315 OG SER A 21 19.556 -17.512 -6.853 1.00 0.00 O ATOM 0 H SER A 21 18.297 -20.284 -9.154 1.00 0.00 H new ATOM 0 HA SER A 21 17.094 -18.474 -7.316 1.00 0.00 H new ATOM 0 HB2 SER A 21 19.282 -19.545 -6.982 1.00 0.00 H new ATOM 0 HB3 SER A 21 19.912 -18.783 -8.429 1.00 0.00 H new ATOM 0 HG SER A 21 20.058 -17.785 -6.057 1.00 0.00 H new ATOM 321 N ILE A 22 18.251 -17.205 -10.152 1.00 0.00 N ATOM 322 CA ILE A 22 18.177 -16.067 -11.053 1.00 0.00 C ATOM 323 C ILE A 22 16.722 -15.781 -11.414 1.00 0.00 C ATOM 324 O ILE A 22 16.283 -14.634 -11.339 1.00 0.00 O ATOM 325 CB ILE A 22 19.013 -16.359 -12.309 1.00 0.00 C ATOM 326 CG1 ILE A 22 20.513 -16.444 -11.990 1.00 0.00 C ATOM 327 CG2 ILE A 22 18.770 -15.287 -13.371 1.00 0.00 C ATOM 328 CD1 ILE A 22 21.087 -15.155 -11.400 1.00 0.00 C ATOM 0 H ILE A 22 18.821 -17.974 -10.505 1.00 0.00 H new ATOM 0 HA ILE A 22 18.581 -15.181 -10.564 1.00 0.00 H new ATOM 0 HB ILE A 22 18.696 -17.329 -12.692 1.00 0.00 H new ATOM 0 HG12 ILE A 22 20.681 -17.261 -11.289 1.00 0.00 H new ATOM 0 HG13 ILE A 22 21.057 -16.690 -12.902 1.00 0.00 H new ATOM 0 HG21 ILE A 22 19.369 -15.508 -14.254 1.00 0.00 H new ATOM 0 HG22 ILE A 22 17.714 -15.276 -13.642 1.00 0.00 H new ATOM 0 HG23 ILE A 22 19.053 -14.312 -12.975 1.00 0.00 H new ATOM 0 HD11 ILE A 22 22.150 -15.288 -11.200 1.00 0.00 H new ATOM 0 HD12 ILE A 22 20.951 -14.338 -12.109 1.00 0.00 H new ATOM 0 HD13 ILE A 22 20.570 -14.918 -10.470 1.00 0.00 H new ATOM 340 N SER A 23 15.971 -16.811 -11.806 1.00 0.00 N ATOM 341 CA SER A 23 14.574 -16.618 -12.153 1.00 0.00 C ATOM 342 C SER A 23 13.741 -16.239 -10.932 1.00 0.00 C ATOM 343 O SER A 23 12.716 -15.590 -11.089 1.00 0.00 O ATOM 344 CB SER A 23 13.987 -17.858 -12.820 1.00 0.00 C ATOM 345 OG SER A 23 13.955 -18.939 -11.918 1.00 0.00 O ATOM 0 H SER A 23 16.305 -17.771 -11.889 1.00 0.00 H new ATOM 0 HA SER A 23 14.537 -15.793 -12.865 1.00 0.00 H new ATOM 0 HB2 SER A 23 12.979 -17.644 -13.175 1.00 0.00 H new ATOM 0 HB3 SER A 23 14.582 -18.124 -13.693 1.00 0.00 H new ATOM 0 HG SER A 23 14.871 -19.197 -11.684 1.00 0.00 H new ATOM 351 N SER A 24 14.150 -16.622 -9.721 1.00 0.00 N ATOM 352 CA SER A 24 13.425 -16.206 -8.527 1.00 0.00 C ATOM 353 C SER A 24 13.418 -14.685 -8.439 1.00 0.00 C ATOM 354 O SER A 24 12.365 -14.072 -8.247 1.00 0.00 O ATOM 355 CB SER A 24 14.036 -16.833 -7.276 1.00 0.00 C ATOM 356 OG SER A 24 13.910 -18.237 -7.336 1.00 0.00 O ATOM 0 H SER A 24 14.965 -17.209 -9.546 1.00 0.00 H new ATOM 0 HA SER A 24 12.394 -16.555 -8.594 1.00 0.00 H new ATOM 0 HB2 SER A 24 15.087 -16.556 -7.195 1.00 0.00 H new ATOM 0 HB3 SER A 24 13.536 -16.451 -6.386 1.00 0.00 H new ATOM 0 HG SER A 24 14.205 -18.555 -8.215 1.00 0.00 H new ATOM 362 N ALA A 25 14.591 -14.065 -8.579 1.00 0.00 N ATOM 363 CA ALA A 25 14.662 -12.611 -8.564 1.00 0.00 C ATOM 364 C ALA A 25 14.017 -12.040 -9.825 1.00 0.00 C ATOM 365 O ALA A 25 13.539 -10.908 -9.805 1.00 0.00 O ATOM 366 CB ALA A 25 16.116 -12.171 -8.434 1.00 0.00 C ATOM 0 H ALA A 25 15.486 -14.539 -8.701 1.00 0.00 H new ATOM 0 HA ALA A 25 14.111 -12.227 -7.706 1.00 0.00 H new ATOM 0 HB1 ALA A 25 16.167 -11.082 -8.423 1.00 0.00 H new ATOM 0 HB2 ALA A 25 16.533 -12.563 -7.507 1.00 0.00 H new ATOM 0 HB3 ALA A 25 16.689 -12.553 -9.279 1.00 0.00 H new ATOM 372 N SER A 26 13.991 -12.808 -10.920 1.00 0.00 N ATOM 373 CA SER A 26 13.334 -12.373 -12.142 1.00 0.00 C ATOM 374 C SER A 26 11.831 -12.266 -11.916 1.00 0.00 C ATOM 375 O SER A 26 11.224 -11.265 -12.274 1.00 0.00 O ATOM 376 CB SER A 26 13.621 -13.356 -13.278 1.00 0.00 C ATOM 377 OG SER A 26 12.993 -12.913 -14.460 1.00 0.00 O ATOM 0 H SER A 26 14.419 -13.732 -10.978 1.00 0.00 H new ATOM 0 HA SER A 26 13.724 -11.393 -12.418 1.00 0.00 H new ATOM 0 HB2 SER A 26 14.696 -13.440 -13.436 1.00 0.00 H new ATOM 0 HB3 SER A 26 13.259 -14.349 -13.013 1.00 0.00 H new ATOM 0 HG SER A 26 12.429 -13.629 -14.819 1.00 0.00 H new ATOM 383 N LYS A 27 11.231 -13.301 -11.318 1.00 0.00 N ATOM 384 CA LYS A 27 9.804 -13.336 -11.036 1.00 0.00 C ATOM 385 C LYS A 27 9.430 -12.120 -10.197 1.00 0.00 C ATOM 386 O LYS A 27 8.405 -11.488 -10.448 1.00 0.00 O ATOM 387 CB LYS A 27 9.476 -14.638 -10.297 1.00 0.00 C ATOM 388 CG LYS A 27 9.692 -15.872 -11.183 1.00 0.00 C ATOM 389 CD LYS A 27 9.955 -17.110 -10.317 1.00 0.00 C ATOM 390 CE LYS A 27 10.603 -18.222 -11.149 1.00 0.00 C ATOM 391 NZ LYS A 27 11.075 -19.333 -10.297 1.00 0.00 N1+ ATOM 0 H LYS A 27 11.730 -14.138 -11.017 1.00 0.00 H new ATOM 0 HA LYS A 27 9.229 -13.306 -11.961 1.00 0.00 H new ATOM 0 HB2 LYS A 27 10.100 -14.717 -9.407 1.00 0.00 H new ATOM 0 HB3 LYS A 27 8.440 -14.612 -9.958 1.00 0.00 H new ATOM 0 HG2 LYS A 27 8.815 -16.037 -11.808 1.00 0.00 H new ATOM 0 HG3 LYS A 27 10.534 -15.703 -11.854 1.00 0.00 H new ATOM 0 HD2 LYS A 27 10.606 -16.846 -9.483 1.00 0.00 H new ATOM 0 HD3 LYS A 27 9.018 -17.467 -9.889 1.00 0.00 H new ATOM 0 HE2 LYS A 27 9.884 -18.600 -11.876 1.00 0.00 H new ATOM 0 HE3 LYS A 27 11.441 -17.814 -11.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 10.934 -20.236 -10.794 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 12.086 -19.206 -10.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 10.537 -19.340 -9.407 1.00 0.00 H new ATOM 405 N TRP A 28 10.257 -11.789 -9.200 1.00 0.00 N ATOM 406 CA TRP A 28 10.027 -10.599 -8.398 1.00 0.00 C ATOM 407 C TRP A 28 10.040 -9.342 -9.266 1.00 0.00 C ATOM 408 O TRP A 28 9.099 -8.554 -9.220 1.00 0.00 O ATOM 409 CB TRP A 28 11.081 -10.496 -7.297 1.00 0.00 C ATOM 410 CG TRP A 28 11.145 -9.159 -6.627 1.00 0.00 C ATOM 411 CD1 TRP A 28 10.157 -8.600 -5.894 1.00 0.00 C ATOM 412 CD2 TRP A 28 12.242 -8.193 -6.619 1.00 0.00 C ATOM 413 NE1 TRP A 28 10.555 -7.358 -5.445 1.00 0.00 N ATOM 414 CE2 TRP A 28 11.838 -7.055 -5.863 1.00 0.00 C ATOM 415 CE3 TRP A 28 13.532 -8.157 -7.180 1.00 0.00 C ATOM 416 CZ2 TRP A 28 12.671 -5.945 -5.671 1.00 0.00 C ATOM 417 CZ3 TRP A 28 14.369 -7.043 -7.003 1.00 0.00 C ATOM 418 CH2 TRP A 28 13.943 -5.940 -6.251 1.00 0.00 C ATOM 0 H TRP A 28 11.082 -12.327 -8.936 1.00 0.00 H new ATOM 0 HA TRP A 28 9.042 -10.681 -7.939 1.00 0.00 H new ATOM 0 HB2 TRP A 28 10.878 -11.257 -6.544 1.00 0.00 H new ATOM 0 HB3 TRP A 28 12.058 -10.722 -7.724 1.00 0.00 H new ATOM 0 HD1 TRP A 28 9.200 -9.057 -5.690 1.00 0.00 H new ATOM 0 HE1 TRP A 28 9.976 -6.741 -4.876 1.00 0.00 H new ATOM 0 HE3 TRP A 28 13.884 -9.000 -7.756 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 12.335 -5.104 -5.083 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 15.352 -7.036 -7.451 1.00 0.00 H new ATOM 0 HH2 TRP A 28 14.595 -5.089 -6.120 1.00 0.00 H new ATOM 429 N LEU A 29 11.096 -9.146 -10.060 1.00 0.00 N ATOM 430 CA LEU A 29 11.211 -7.955 -10.883 1.00 0.00 C ATOM 431 C LEU A 29 10.069 -7.888 -11.887 1.00 0.00 C ATOM 432 O LEU A 29 9.535 -6.812 -12.132 1.00 0.00 O ATOM 433 CB LEU A 29 12.551 -7.980 -11.622 1.00 0.00 C ATOM 434 CG LEU A 29 13.701 -7.516 -10.732 1.00 0.00 C ATOM 435 CD1 LEU A 29 15.026 -7.805 -11.429 1.00 0.00 C ATOM 436 CD2 LEU A 29 13.617 -6.016 -10.446 1.00 0.00 C ATOM 0 H LEU A 29 11.876 -9.797 -10.145 1.00 0.00 H new ATOM 0 HA LEU A 29 11.160 -7.074 -10.243 1.00 0.00 H new ATOM 0 HB2 LEU A 29 12.751 -8.991 -11.976 1.00 0.00 H new ATOM 0 HB3 LEU A 29 12.492 -7.340 -12.502 1.00 0.00 H new ATOM 0 HG LEU A 29 13.634 -8.056 -9.787 1.00 0.00 H new ATOM 0 HD11 LEU A 29 15.850 -7.475 -10.796 1.00 0.00 H new ATOM 0 HD12 LEU A 29 15.115 -8.876 -11.611 1.00 0.00 H new ATOM 0 HD13 LEU A 29 15.062 -7.271 -12.379 1.00 0.00 H new ATOM 0 HD21 LEU A 29 14.451 -5.720 -9.810 1.00 0.00 H new ATOM 0 HD22 LEU A 29 13.662 -5.464 -11.385 1.00 0.00 H new ATOM 0 HD23 LEU A 29 12.678 -5.794 -9.940 1.00 0.00 H new ATOM 448 N LEU A 30 9.685 -9.025 -12.474 1.00 0.00 N ATOM 449 CA LEU A 30 8.627 -9.052 -13.463 1.00 0.00 C ATOM 450 C LEU A 30 7.300 -8.632 -12.841 1.00 0.00 C ATOM 451 O LEU A 30 6.432 -8.137 -13.552 1.00 0.00 O ATOM 452 CB LEU A 30 8.526 -10.461 -14.043 1.00 0.00 C ATOM 453 CG LEU A 30 9.718 -10.800 -14.941 1.00 0.00 C ATOM 454 CD1 LEU A 30 9.729 -12.305 -15.182 1.00 0.00 C ATOM 455 CD2 LEU A 30 9.622 -10.065 -16.274 1.00 0.00 C ATOM 0 H LEU A 30 10.098 -9.936 -12.274 1.00 0.00 H new ATOM 0 HA LEU A 30 8.858 -8.346 -14.261 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.468 -11.184 -13.230 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.603 -10.551 -14.616 1.00 0.00 H new ATOM 0 HG LEU A 30 10.639 -10.487 -14.450 1.00 0.00 H new ATOM 0 HD11 LEU A 30 10.573 -12.565 -15.821 1.00 0.00 H new ATOM 0 HD12 LEU A 30 9.822 -12.825 -14.229 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.800 -12.602 -15.669 1.00 0.00 H new ATOM 0 HD21 LEU A 30 10.481 -10.323 -16.894 1.00 0.00 H new ATOM 0 HD22 LEU A 30 8.705 -10.357 -16.785 1.00 0.00 H new ATOM 0 HD23 LEU A 30 9.612 -8.990 -16.097 1.00 0.00 H new ATOM 467 N LEU A 31 7.143 -8.827 -11.526 1.00 0.00 N ATOM 468 CA LEU A 31 6.000 -8.308 -10.783 1.00 0.00 C ATOM 469 C LEU A 31 6.154 -6.816 -10.480 1.00 0.00 C ATOM 470 O LEU A 31 5.155 -6.138 -10.252 1.00 0.00 O ATOM 471 CB LEU A 31 5.831 -9.098 -9.482 1.00 0.00 C ATOM 472 CG LEU A 31 5.257 -10.486 -9.768 1.00 0.00 C ATOM 473 CD1 LEU A 31 5.545 -11.402 -8.580 1.00 0.00 C ATOM 474 CD2 LEU A 31 3.747 -10.404 -9.994 1.00 0.00 C ATOM 0 H LEU A 31 7.806 -9.349 -10.953 1.00 0.00 H new ATOM 0 HA LEU A 31 5.110 -8.427 -11.402 1.00 0.00 H new ATOM 0 HB2 LEU A 31 6.794 -9.193 -8.980 1.00 0.00 H new ATOM 0 HB3 LEU A 31 5.170 -8.557 -8.805 1.00 0.00 H new ATOM 0 HG LEU A 31 5.724 -10.885 -10.669 1.00 0.00 H new ATOM 0 HD11 LEU A 31 5.138 -12.394 -8.778 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.622 -11.475 -8.430 1.00 0.00 H new ATOM 0 HD13 LEU A 31 5.081 -10.992 -7.683 1.00 0.00 H new ATOM 0 HD21 LEU A 31 3.355 -11.401 -10.196 1.00 0.00 H new ATOM 0 HD22 LEU A 31 3.267 -9.999 -9.103 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.541 -9.754 -10.844 1.00 0.00 H new ATOM 486 N GLN A 32 7.384 -6.289 -10.474 1.00 0.00 N ATOM 487 CA GLN A 32 7.605 -4.856 -10.295 1.00 0.00 C ATOM 488 C GLN A 32 7.426 -4.095 -11.613 1.00 0.00 C ATOM 489 O GLN A 32 8.029 -3.043 -11.802 1.00 0.00 O ATOM 490 CB GLN A 32 8.978 -4.559 -9.672 1.00 0.00 C ATOM 491 CG GLN A 32 9.287 -5.410 -8.439 1.00 0.00 C ATOM 492 CD GLN A 32 8.049 -5.696 -7.599 1.00 0.00 C ATOM 493 OE1 GLN A 32 7.466 -4.797 -6.999 1.00 0.00 O ATOM 494 NE2 GLN A 32 7.643 -6.963 -7.559 1.00 0.00 N ATOM 0 H GLN A 32 8.238 -6.835 -10.591 1.00 0.00 H new ATOM 0 HA GLN A 32 6.847 -4.503 -9.595 1.00 0.00 H new ATOM 0 HB2 GLN A 32 9.752 -4.726 -10.422 1.00 0.00 H new ATOM 0 HB3 GLN A 32 9.023 -3.505 -9.397 1.00 0.00 H new ATOM 0 HG2 GLN A 32 9.733 -6.353 -8.755 1.00 0.00 H new ATOM 0 HG3 GLN A 32 10.028 -4.898 -7.825 1.00 0.00 H new ATOM 0 HE21 GLN A 32 8.156 -7.679 -8.072 1.00 0.00 H new ATOM 0 HE22 GLN A 32 6.819 -7.217 -7.015 1.00 0.00 H new ATOM 503 N TYR A 33 6.601 -4.623 -12.527 1.00 0.00 N ATOM 504 CA TYR A 33 6.402 -4.054 -13.859 1.00 0.00 C ATOM 505 C TYR A 33 6.004 -2.578 -13.804 1.00 0.00 C ATOM 506 O TYR A 33 6.301 -1.814 -14.719 1.00 0.00 O ATOM 507 CB TYR A 33 5.310 -4.865 -14.570 1.00 0.00 C ATOM 508 CG TYR A 33 4.042 -5.045 -13.764 1.00 0.00 C ATOM 509 CD1 TYR A 33 3.828 -6.246 -13.073 1.00 0.00 C ATOM 510 CD2 TYR A 33 3.081 -4.025 -13.699 1.00 0.00 C ATOM 511 CE1 TYR A 33 2.677 -6.436 -12.299 1.00 0.00 C ATOM 512 CE2 TYR A 33 1.918 -4.205 -12.929 1.00 0.00 C ATOM 513 CZ TYR A 33 1.715 -5.411 -12.226 1.00 0.00 C ATOM 514 OH TYR A 33 0.590 -5.583 -11.477 1.00 0.00 O ATOM 0 H TYR A 33 6.050 -5.464 -12.357 1.00 0.00 H new ATOM 0 HA TYR A 33 7.344 -4.107 -14.404 1.00 0.00 H new ATOM 0 HB2 TYR A 33 5.062 -4.372 -15.510 1.00 0.00 H new ATOM 0 HB3 TYR A 33 5.709 -5.848 -14.821 1.00 0.00 H new ATOM 0 HD1 TYR A 33 4.562 -7.036 -13.139 1.00 0.00 H new ATOM 0 HD2 TYR A 33 3.234 -3.103 -14.240 1.00 0.00 H new ATOM 0 HE1 TYR A 33 2.528 -7.361 -11.762 1.00 0.00 H new ATOM 0 HE2 TYR A 33 1.179 -3.419 -12.876 1.00 0.00 H new ATOM 0 HH TYR A 33 0.032 -4.779 -11.535 1.00 0.00 H new ATOM 524 N ARG A 34 5.330 -2.189 -12.723 1.00 0.00 N ATOM 525 CA ARG A 34 4.859 -0.833 -12.471 1.00 0.00 C ATOM 526 C ARG A 34 5.996 0.121 -12.102 1.00 0.00 C ATOM 527 O ARG A 34 5.824 1.336 -12.182 1.00 0.00 O ATOM 528 CB ARG A 34 3.823 -0.870 -11.341 1.00 0.00 C ATOM 529 CG ARG A 34 4.193 -1.915 -10.280 1.00 0.00 C ATOM 530 CD ARG A 34 3.385 -1.736 -8.993 1.00 0.00 C ATOM 531 NE ARG A 34 3.428 -2.954 -8.178 1.00 0.00 N ATOM 532 CZ ARG A 34 4.532 -3.473 -7.622 1.00 0.00 C ATOM 533 NH1 ARG A 34 5.713 -2.867 -7.703 1.00 0.00 N1+ ATOM 534 NH2 ARG A 34 4.461 -4.629 -6.964 1.00 0.00 N ATOM 0 H ARG A 34 5.089 -2.836 -11.972 1.00 0.00 H new ATOM 0 HA ARG A 34 4.412 -0.455 -13.391 1.00 0.00 H new ATOM 0 HB2 ARG A 34 3.753 0.114 -10.877 1.00 0.00 H new ATOM 0 HB3 ARG A 34 2.840 -1.099 -11.753 1.00 0.00 H new ATOM 0 HG2 ARG A 34 4.021 -2.914 -10.680 1.00 0.00 H new ATOM 0 HG3 ARG A 34 5.257 -1.841 -10.054 1.00 0.00 H new ATOM 0 HD2 ARG A 34 3.783 -0.897 -8.422 1.00 0.00 H new ATOM 0 HD3 ARG A 34 2.351 -1.493 -9.238 1.00 0.00 H new ATOM 0 HE ARG A 34 2.548 -3.446 -8.022 1.00 0.00 H new ATOM 0 HH11 ARG A 34 5.798 -1.980 -8.200 1.00 0.00 H new ATOM 0 HH12 ARG A 34 6.534 -3.289 -7.269 1.00 0.00 H new ATOM 0 HH21 ARG A 34 3.569 -5.117 -6.884 1.00 0.00 H new ATOM 0 HH22 ARG A 34 5.299 -5.027 -6.540 1.00 0.00 H new ATOM 548 N ASP A 35 7.148 -0.418 -11.700 1.00 0.00 N ATOM 549 CA ASP A 35 8.272 0.354 -11.202 1.00 0.00 C ATOM 550 C ASP A 35 9.560 0.069 -11.969 1.00 0.00 C ATOM 551 O ASP A 35 10.641 0.426 -11.510 1.00 0.00 O ATOM 552 CB ASP A 35 8.412 0.076 -9.709 1.00 0.00 C ATOM 553 CG ASP A 35 7.131 0.450 -8.973 1.00 0.00 C ATOM 554 OD1 ASP A 35 6.499 -0.468 -8.406 1.00 0.00 O ATOM 555 OD2 ASP A 35 6.807 1.657 -8.995 1.00 0.00 O1- ATOM 0 H ASP A 35 7.323 -1.423 -11.714 1.00 0.00 H new ATOM 0 HA ASP A 35 8.082 1.416 -11.359 1.00 0.00 H new ATOM 0 HB2 ASP A 35 8.635 -0.979 -9.549 1.00 0.00 H new ATOM 0 HB3 ASP A 35 9.250 0.644 -9.304 1.00 0.00 H new ATOM 560 N ALA A 36 9.446 -0.573 -13.133 1.00 0.00 N ATOM 561 CA ALA A 36 10.581 -1.028 -13.922 1.00 0.00 C ATOM 562 C ALA A 36 11.664 0.041 -14.119 1.00 0.00 C ATOM 563 O ALA A 36 12.842 -0.297 -14.026 1.00 0.00 O ATOM 564 CB ALA A 36 10.073 -1.530 -15.274 1.00 0.00 C ATOM 0 H ALA A 36 8.545 -0.793 -13.557 1.00 0.00 H new ATOM 0 HA ALA A 36 11.061 -1.833 -13.366 1.00 0.00 H new ATOM 0 HB1 ALA A 36 10.915 -1.874 -15.874 1.00 0.00 H new ATOM 0 HB2 ALA A 36 9.378 -2.355 -15.118 1.00 0.00 H new ATOM 0 HB3 ALA A 36 9.563 -0.720 -15.795 1.00 0.00 H new ATOM 570 N PRO A 37 11.328 1.312 -14.385 1.00 0.00 N ATOM 571 CA PRO A 37 12.330 2.358 -14.534 1.00 0.00 C ATOM 572 C PRO A 37 13.105 2.576 -13.239 1.00 0.00 C ATOM 573 O PRO A 37 14.307 2.830 -13.267 1.00 0.00 O ATOM 574 CB PRO A 37 11.556 3.624 -14.905 1.00 0.00 C ATOM 575 CG PRO A 37 10.219 3.103 -15.426 1.00 0.00 C ATOM 576 CD PRO A 37 9.997 1.855 -14.581 1.00 0.00 C ATOM 0 HA PRO A 37 13.064 2.088 -15.293 1.00 0.00 H new ATOM 0 HB2 PRO A 37 11.421 4.276 -14.042 1.00 0.00 H new ATOM 0 HB3 PRO A 37 12.081 4.204 -15.664 1.00 0.00 H new ATOM 0 HG2 PRO A 37 9.420 3.832 -15.291 1.00 0.00 H new ATOM 0 HG3 PRO A 37 10.261 2.870 -16.490 1.00 0.00 H new ATOM 0 HD2 PRO A 37 9.523 2.098 -13.630 1.00 0.00 H new ATOM 0 HD3 PRO A 37 9.347 1.142 -15.088 1.00 0.00 H new ATOM 584 N LYS A 38 12.416 2.475 -12.097 1.00 0.00 N ATOM 585 CA LYS A 38 13.029 2.685 -10.794 1.00 0.00 C ATOM 586 C LYS A 38 14.039 1.580 -10.508 1.00 0.00 C ATOM 587 O LYS A 38 15.174 1.856 -10.123 1.00 0.00 O ATOM 588 CB LYS A 38 11.951 2.710 -9.705 1.00 0.00 C ATOM 589 CG LYS A 38 11.372 4.115 -9.485 1.00 0.00 C ATOM 590 CD LYS A 38 10.431 4.565 -10.607 1.00 0.00 C ATOM 591 CE LYS A 38 9.206 3.656 -10.694 1.00 0.00 C ATOM 592 NZ LYS A 38 8.405 3.700 -9.454 1.00 0.00 N1+ ATOM 0 H LYS A 38 11.423 2.246 -12.057 1.00 0.00 H new ATOM 0 HA LYS A 38 13.548 3.643 -10.797 1.00 0.00 H new ATOM 0 HB2 LYS A 38 11.146 2.027 -9.979 1.00 0.00 H new ATOM 0 HB3 LYS A 38 12.375 2.344 -8.770 1.00 0.00 H new ATOM 0 HG2 LYS A 38 10.832 4.134 -8.538 1.00 0.00 H new ATOM 0 HG3 LYS A 38 12.191 4.829 -9.399 1.00 0.00 H new ATOM 0 HD2 LYS A 38 10.114 5.593 -10.430 1.00 0.00 H new ATOM 0 HD3 LYS A 38 10.963 4.556 -11.558 1.00 0.00 H new ATOM 0 HE2 LYS A 38 8.587 3.959 -11.538 1.00 0.00 H new ATOM 0 HE3 LYS A 38 9.526 2.632 -10.885 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 7.573 3.084 -9.556 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 8.984 3.371 -8.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 8.093 4.676 -9.277 1.00 0.00 H new ATOM 606 N VAL A 39 13.628 0.325 -10.697 1.00 0.00 N ATOM 607 CA VAL A 39 14.495 -0.811 -10.438 1.00 0.00 C ATOM 608 C VAL A 39 15.667 -0.824 -11.421 1.00 0.00 C ATOM 609 O VAL A 39 16.736 -1.328 -11.082 1.00 0.00 O ATOM 610 CB VAL A 39 13.711 -2.135 -10.464 1.00 0.00 C ATOM 611 CG1 VAL A 39 13.721 -2.754 -9.067 1.00 0.00 C ATOM 612 CG2 VAL A 39 12.248 -1.968 -10.854 1.00 0.00 C ATOM 0 H VAL A 39 12.696 0.076 -11.030 1.00 0.00 H new ATOM 0 HA VAL A 39 14.903 -0.707 -9.433 1.00 0.00 H new ATOM 0 HB VAL A 39 14.202 -2.759 -11.210 1.00 0.00 H new ATOM 0 HG11 VAL A 39 13.167 -3.692 -9.081 1.00 0.00 H new ATOM 0 HG12 VAL A 39 14.750 -2.945 -8.761 1.00 0.00 H new ATOM 0 HG13 VAL A 39 13.254 -2.067 -8.361 1.00 0.00 H new ATOM 0 HG21 VAL A 39 11.757 -2.941 -10.852 1.00 0.00 H new ATOM 0 HG22 VAL A 39 11.754 -1.311 -10.139 1.00 0.00 H new ATOM 0 HG23 VAL A 39 12.185 -1.532 -11.851 1.00 0.00 H new ATOM 622 N ALA A 40 15.484 -0.279 -12.629 1.00 0.00 N ATOM 623 CA ALA A 40 16.557 -0.194 -13.610 1.00 0.00 C ATOM 624 C ALA A 40 17.632 0.796 -13.168 1.00 0.00 C ATOM 625 O ALA A 40 18.821 0.536 -13.360 1.00 0.00 O ATOM 626 CB ALA A 40 15.975 0.223 -14.958 1.00 0.00 C ATOM 0 H ALA A 40 14.596 0.110 -12.946 1.00 0.00 H new ATOM 0 HA ALA A 40 17.027 -1.173 -13.701 1.00 0.00 H new ATOM 0 HB1 ALA A 40 16.775 0.288 -15.695 1.00 0.00 H new ATOM 0 HB2 ALA A 40 15.242 -0.516 -15.282 1.00 0.00 H new ATOM 0 HB3 ALA A 40 15.492 1.195 -14.861 1.00 0.00 H new ATOM 632 N GLU A 41 17.227 1.923 -12.581 1.00 0.00 N ATOM 633 CA GLU A 41 18.185 2.892 -12.075 1.00 0.00 C ATOM 634 C GLU A 41 18.998 2.272 -10.941 1.00 0.00 C ATOM 635 O GLU A 41 20.199 2.520 -10.846 1.00 0.00 O ATOM 636 CB GLU A 41 17.455 4.156 -11.612 1.00 0.00 C ATOM 637 CG GLU A 41 16.885 4.917 -12.810 1.00 0.00 C ATOM 638 CD GLU A 41 17.997 5.460 -13.696 1.00 0.00 C ATOM 639 OE1 GLU A 41 18.776 6.302 -13.195 1.00 0.00 O ATOM 640 OE2 GLU A 41 18.065 5.033 -14.870 1.00 0.00 O1- ATOM 0 H GLU A 41 16.249 2.181 -12.447 1.00 0.00 H new ATOM 0 HA GLU A 41 18.874 3.174 -12.871 1.00 0.00 H new ATOM 0 HB2 GLU A 41 16.650 3.888 -10.928 1.00 0.00 H new ATOM 0 HB3 GLU A 41 18.142 4.798 -11.060 1.00 0.00 H new ATOM 0 HG2 GLU A 41 16.243 4.256 -13.392 1.00 0.00 H new ATOM 0 HG3 GLU A 41 16.262 5.739 -12.459 1.00 0.00 H new ATOM 647 N MET A 42 18.367 1.467 -10.080 1.00 0.00 N ATOM 648 CA MET A 42 19.113 0.787 -9.031 1.00 0.00 C ATOM 649 C MET A 42 20.005 -0.307 -9.614 1.00 0.00 C ATOM 650 O MET A 42 21.119 -0.499 -9.137 1.00 0.00 O ATOM 651 CB MET A 42 18.168 0.171 -7.998 1.00 0.00 C ATOM 652 CG MET A 42 17.242 1.204 -7.362 1.00 0.00 C ATOM 653 SD MET A 42 17.038 1.005 -5.571 1.00 0.00 S ATOM 654 CE MET A 42 16.492 -0.720 -5.514 1.00 0.00 C ATOM 0 H MET A 42 17.365 1.277 -10.091 1.00 0.00 H new ATOM 0 HA MET A 42 19.739 1.534 -8.542 1.00 0.00 H new ATOM 0 HB2 MET A 42 17.569 -0.604 -8.476 1.00 0.00 H new ATOM 0 HB3 MET A 42 18.755 -0.315 -7.218 1.00 0.00 H new ATOM 0 HG2 MET A 42 17.633 2.201 -7.565 1.00 0.00 H new ATOM 0 HG3 MET A 42 16.263 1.142 -7.838 1.00 0.00 H new ATOM 0 HE1 MET A 42 15.613 -0.802 -4.875 1.00 0.00 H new ATOM 0 HE2 MET A 42 16.242 -1.056 -6.520 1.00 0.00 H new ATOM 0 HE3 MET A 42 17.292 -1.342 -5.113 1.00 0.00 H new ATOM 664 N TRP A 43 19.520 -1.018 -10.639 1.00 0.00 N ATOM 665 CA TRP A 43 20.274 -2.100 -11.253 1.00 0.00 C ATOM 666 C TRP A 43 21.586 -1.585 -11.826 1.00 0.00 C ATOM 667 O TRP A 43 22.650 -2.106 -11.490 1.00 0.00 O ATOM 668 CB TRP A 43 19.430 -2.765 -12.339 1.00 0.00 C ATOM 669 CG TRP A 43 20.095 -3.896 -13.061 1.00 0.00 C ATOM 670 CD1 TRP A 43 20.316 -5.134 -12.559 1.00 0.00 C ATOM 671 CD2 TRP A 43 20.639 -3.925 -14.417 1.00 0.00 C ATOM 672 NE1 TRP A 43 20.941 -5.922 -13.505 1.00 0.00 N ATOM 673 CE2 TRP A 43 21.183 -5.219 -14.663 1.00 0.00 C ATOM 674 CE3 TRP A 43 20.724 -2.992 -15.468 1.00 0.00 C ATOM 675 CZ2 TRP A 43 21.800 -5.558 -15.874 1.00 0.00 C ATOM 676 CZ3 TRP A 43 21.331 -3.329 -16.689 1.00 0.00 C ATOM 677 CH2 TRP A 43 21.876 -4.603 -16.890 1.00 0.00 C ATOM 0 H TRP A 43 18.604 -0.857 -11.057 1.00 0.00 H new ATOM 0 HA TRP A 43 20.513 -2.841 -10.491 1.00 0.00 H new ATOM 0 HB2 TRP A 43 18.510 -3.135 -11.886 1.00 0.00 H new ATOM 0 HB3 TRP A 43 19.144 -2.008 -13.069 1.00 0.00 H new ATOM 0 HD1 TRP A 43 20.044 -5.457 -11.565 1.00 0.00 H new ATOM 0 HE1 TRP A 43 21.191 -6.901 -13.364 1.00 0.00 H new ATOM 0 HE3 TRP A 43 20.316 -2.001 -15.333 1.00 0.00 H new ATOM 0 HZ2 TRP A 43 22.212 -6.546 -16.020 1.00 0.00 H new ATOM 0 HZ3 TRP A 43 21.378 -2.597 -17.482 1.00 0.00 H new ATOM 0 HH2 TRP A 43 22.354 -4.846 -17.828 1.00 0.00 H new ATOM 688 N LYS A 44 21.514 -0.566 -12.690 1.00 0.00 N ATOM 689 CA LYS A 44 22.719 -0.018 -13.283 1.00 0.00 C ATOM 690 C LYS A 44 23.653 0.498 -12.197 1.00 0.00 C ATOM 691 O LYS A 44 24.843 0.199 -12.228 1.00 0.00 O ATOM 692 CB LYS A 44 22.384 1.072 -14.308 1.00 0.00 C ATOM 693 CG LYS A 44 21.860 2.358 -13.673 1.00 0.00 C ATOM 694 CD LYS A 44 21.457 3.351 -14.757 1.00 0.00 C ATOM 695 CE LYS A 44 21.234 4.710 -14.106 1.00 0.00 C ATOM 696 NZ LYS A 44 20.648 5.674 -15.053 1.00 0.00 N1+ ATOM 0 H LYS A 44 20.647 -0.117 -12.984 1.00 0.00 H new ATOM 0 HA LYS A 44 23.235 -0.814 -13.820 1.00 0.00 H new ATOM 0 HB2 LYS A 44 23.277 1.300 -14.890 1.00 0.00 H new ATOM 0 HB3 LYS A 44 21.638 0.689 -15.005 1.00 0.00 H new ATOM 0 HG2 LYS A 44 21.004 2.136 -13.036 1.00 0.00 H new ATOM 0 HG3 LYS A 44 22.627 2.796 -13.034 1.00 0.00 H new ATOM 0 HD2 LYS A 44 22.235 3.418 -15.518 1.00 0.00 H new ATOM 0 HD3 LYS A 44 20.549 3.017 -15.258 1.00 0.00 H new ATOM 0 HE2 LYS A 44 20.575 4.598 -13.245 1.00 0.00 H new ATOM 0 HE3 LYS A 44 22.183 5.096 -13.733 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 20.478 6.578 -14.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 21.304 5.824 -15.846 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 19.747 5.301 -15.415 1.00 0.00 H new ATOM 710 N GLU A 45 23.140 1.267 -11.232 1.00 0.00 N ATOM 711 CA GLU A 45 23.963 1.820 -10.187 1.00 0.00 C ATOM 712 C GLU A 45 24.658 0.711 -9.401 1.00 0.00 C ATOM 713 O GLU A 45 25.857 0.797 -9.158 1.00 0.00 O ATOM 714 CB GLU A 45 23.054 2.689 -9.323 1.00 0.00 C ATOM 715 CG GLU A 45 23.863 3.730 -8.563 1.00 0.00 C ATOM 716 CD GLU A 45 24.233 3.264 -7.159 1.00 0.00 C ATOM 717 OE1 GLU A 45 25.447 3.135 -6.887 1.00 0.00 O ATOM 718 OE2 GLU A 45 23.290 3.042 -6.369 1.00 0.00 O1- ATOM 0 H GLU A 45 22.152 1.513 -11.165 1.00 0.00 H new ATOM 0 HA GLU A 45 24.769 2.433 -10.590 1.00 0.00 H new ATOM 0 HB2 GLU A 45 22.314 3.185 -9.951 1.00 0.00 H new ATOM 0 HB3 GLU A 45 22.507 2.062 -8.619 1.00 0.00 H new ATOM 0 HG2 GLU A 45 24.772 3.957 -9.119 1.00 0.00 H new ATOM 0 HG3 GLU A 45 23.290 4.655 -8.497 1.00 0.00 H new ATOM 725 N TYR A 46 23.913 -0.327 -9.006 1.00 0.00 N ATOM 726 CA TYR A 46 24.462 -1.421 -8.222 1.00 0.00 C ATOM 727 C TYR A 46 25.703 -2.006 -8.890 1.00 0.00 C ATOM 728 O TYR A 46 26.758 -2.100 -8.264 1.00 0.00 O ATOM 729 CB TYR A 46 23.412 -2.526 -8.065 1.00 0.00 C ATOM 730 CG TYR A 46 24.015 -3.913 -8.146 1.00 0.00 C ATOM 731 CD1 TYR A 46 23.867 -4.657 -9.330 1.00 0.00 C ATOM 732 CD2 TYR A 46 24.725 -4.447 -7.061 1.00 0.00 C ATOM 733 CE1 TYR A 46 24.474 -5.913 -9.453 1.00 0.00 C ATOM 734 CE2 TYR A 46 25.329 -5.706 -7.176 1.00 0.00 C ATOM 735 CZ TYR A 46 25.220 -6.431 -8.376 1.00 0.00 C ATOM 736 OH TYR A 46 25.837 -7.635 -8.484 1.00 0.00 O ATOM 0 H TYR A 46 22.921 -0.426 -9.222 1.00 0.00 H new ATOM 0 HA TYR A 46 24.741 -1.028 -7.244 1.00 0.00 H new ATOM 0 HB2 TYR A 46 22.906 -2.409 -7.107 1.00 0.00 H new ATOM 0 HB3 TYR A 46 22.655 -2.416 -8.841 1.00 0.00 H new ATOM 0 HD1 TYR A 46 23.284 -4.259 -10.147 1.00 0.00 H new ATOM 0 HD2 TYR A 46 24.806 -3.890 -6.140 1.00 0.00 H new ATOM 0 HE1 TYR A 46 24.371 -6.480 -10.366 1.00 0.00 H new ATOM 0 HE2 TYR A 46 25.878 -6.120 -6.343 1.00 0.00 H new ATOM 0 HH TYR A 46 25.535 -8.085 -9.301 1.00 0.00 H new ATOM 746 N MET A 47 25.582 -2.403 -10.158 1.00 0.00 N ATOM 747 CA MET A 47 26.676 -3.057 -10.854 1.00 0.00 C ATOM 748 C MET A 47 27.747 -2.065 -11.294 1.00 0.00 C ATOM 749 O MET A 47 28.902 -2.453 -11.470 1.00 0.00 O ATOM 750 CB MET A 47 26.102 -3.839 -12.025 1.00 0.00 C ATOM 751 CG MET A 47 25.337 -2.940 -12.989 1.00 0.00 C ATOM 752 SD MET A 47 24.068 -3.857 -13.890 1.00 0.00 S ATOM 753 CE MET A 47 25.136 -5.189 -14.472 1.00 0.00 C ATOM 0 H MET A 47 24.738 -2.281 -10.717 1.00 0.00 H new ATOM 0 HA MET A 47 27.178 -3.745 -10.174 1.00 0.00 H new ATOM 0 HB2 MET A 47 26.910 -4.339 -12.559 1.00 0.00 H new ATOM 0 HB3 MET A 47 25.438 -4.618 -11.651 1.00 0.00 H new ATOM 0 HG2 MET A 47 24.873 -2.124 -12.435 1.00 0.00 H new ATOM 0 HG3 MET A 47 26.033 -2.490 -13.697 1.00 0.00 H new ATOM 0 HE1 MET A 47 24.664 -5.692 -15.316 1.00 0.00 H new ATOM 0 HE2 MET A 47 26.095 -4.776 -14.786 1.00 0.00 H new ATOM 0 HE3 MET A 47 25.296 -5.905 -13.666 1.00 0.00 H new ATOM 763 N LEU A 48 27.387 -0.793 -11.478 1.00 0.00 N ATOM 764 CA LEU A 48 28.385 0.245 -11.688 1.00 0.00 C ATOM 765 C LEU A 48 29.297 0.397 -10.467 1.00 0.00 C ATOM 766 O LEU A 48 30.433 0.839 -10.637 1.00 0.00 O ATOM 767 CB LEU A 48 27.705 1.577 -12.020 1.00 0.00 C ATOM 768 CG LEU A 48 27.171 1.614 -13.456 1.00 0.00 C ATOM 769 CD1 LEU A 48 26.271 2.836 -13.629 1.00 0.00 C ATOM 770 CD2 LEU A 48 28.315 1.710 -14.466 1.00 0.00 C ATOM 0 H LEU A 48 26.421 -0.464 -11.485 1.00 0.00 H new ATOM 0 HA LEU A 48 29.007 -0.052 -12.532 1.00 0.00 H new ATOM 0 HB2 LEU A 48 26.883 1.746 -11.324 1.00 0.00 H new ATOM 0 HB3 LEU A 48 28.416 2.391 -11.878 1.00 0.00 H new ATOM 0 HG LEU A 48 26.614 0.694 -13.635 1.00 0.00 H new ATOM 0 HD11 LEU A 48 25.889 2.865 -14.650 1.00 0.00 H new ATOM 0 HD12 LEU A 48 25.436 2.775 -12.931 1.00 0.00 H new ATOM 0 HD13 LEU A 48 26.844 3.741 -13.430 1.00 0.00 H new ATOM 0 HD21 LEU A 48 27.907 1.735 -15.477 1.00 0.00 H new ATOM 0 HD22 LEU A 48 28.886 2.620 -14.283 1.00 0.00 H new ATOM 0 HD23 LEU A 48 28.968 0.844 -14.359 1.00 0.00 H new ATOM 782 N ARG A 49 28.835 0.046 -9.255 1.00 0.00 N ATOM 783 CA ARG A 49 29.689 0.103 -8.071 1.00 0.00 C ATOM 784 C ARG A 49 30.785 -0.954 -8.186 1.00 0.00 C ATOM 785 O ARG A 49 30.490 -2.111 -8.483 1.00 0.00 O ATOM 786 CB ARG A 49 28.893 -0.195 -6.796 1.00 0.00 C ATOM 787 CG ARG A 49 27.769 0.795 -6.505 1.00 0.00 C ATOM 788 CD ARG A 49 26.882 0.219 -5.400 1.00 0.00 C ATOM 789 NE ARG A 49 25.622 0.961 -5.272 1.00 0.00 N ATOM 790 CZ ARG A 49 24.596 0.569 -4.502 1.00 0.00 C ATOM 791 NH1 ARG A 49 24.679 -0.534 -3.754 1.00 0.00 N1+ ATOM 792 NH2 ARG A 49 23.472 1.283 -4.473 1.00 0.00 N ATOM 0 H ARG A 49 27.884 -0.276 -9.077 1.00 0.00 H new ATOM 0 HA ARG A 49 30.108 1.108 -8.013 1.00 0.00 H new ATOM 0 HB2 ARG A 49 28.467 -1.195 -6.874 1.00 0.00 H new ATOM 0 HB3 ARG A 49 29.579 -0.206 -5.949 1.00 0.00 H new ATOM 0 HG2 ARG A 49 28.182 1.755 -6.196 1.00 0.00 H new ATOM 0 HG3 ARG A 49 27.182 0.975 -7.405 1.00 0.00 H new ATOM 0 HD2 ARG A 49 26.667 -0.828 -5.614 1.00 0.00 H new ATOM 0 HD3 ARG A 49 27.418 0.247 -4.452 1.00 0.00 H new ATOM 0 HE ARG A 49 25.520 1.827 -5.801 1.00 0.00 H new ATOM 0 HH11 ARG A 49 25.532 -1.093 -3.762 1.00 0.00 H new ATOM 0 HH12 ARG A 49 23.889 -0.818 -3.174 1.00 0.00 H new ATOM 0 HH21 ARG A 49 23.391 2.129 -5.037 1.00 0.00 H new ATOM 0 HH22 ARG A 49 22.693 0.984 -3.887 1.00 0.00 H new ATOM 806 N PRO A 50 32.052 -0.593 -7.958 1.00 0.00 N ATOM 807 CA PRO A 50 33.129 -1.555 -7.846 1.00 0.00 C ATOM 808 C PRO A 50 33.188 -2.138 -6.436 1.00 0.00 C ATOM 809 O PRO A 50 34.043 -2.976 -6.155 1.00 0.00 O ATOM 810 CB PRO A 50 34.388 -0.745 -8.142 1.00 0.00 C ATOM 811 CG PRO A 50 34.047 0.616 -7.528 1.00 0.00 C ATOM 812 CD PRO A 50 32.548 0.760 -7.796 1.00 0.00 C ATOM 0 HA PRO A 50 33.004 -2.400 -8.523 1.00 0.00 H new ATOM 0 HB2 PRO A 50 35.274 -1.187 -7.686 1.00 0.00 H new ATOM 0 HB3 PRO A 50 34.583 -0.672 -9.212 1.00 0.00 H new ATOM 0 HG2 PRO A 50 34.269 0.642 -6.461 1.00 0.00 H new ATOM 0 HG3 PRO A 50 34.617 1.421 -7.992 1.00 0.00 H new ATOM 0 HD2 PRO A 50 32.048 1.265 -6.969 1.00 0.00 H new ATOM 0 HD3 PRO A 50 32.365 1.355 -8.691 1.00 0.00 H new ATOM 820 N SER A 51 32.289 -1.701 -5.548 1.00 0.00 N ATOM 821 CA SER A 51 32.219 -2.234 -4.198 1.00 0.00 C ATOM 822 C SER A 51 31.706 -3.671 -4.225 1.00 0.00 C ATOM 823 O SER A 51 31.627 -4.314 -3.182 1.00 0.00 O ATOM 824 CB SER A 51 31.308 -1.352 -3.340 1.00 0.00 C ATOM 825 OG SER A 51 29.978 -1.435 -3.799 1.00 0.00 O ATOM 0 H SER A 51 31.600 -0.976 -5.748 1.00 0.00 H new ATOM 0 HA SER A 51 33.218 -2.235 -3.761 1.00 0.00 H new ATOM 0 HB2 SER A 51 31.361 -1.667 -2.298 1.00 0.00 H new ATOM 0 HB3 SER A 51 31.650 -0.318 -3.378 1.00 0.00 H new ATOM 0 HG SER A 51 29.404 -0.869 -3.242 1.00 0.00 H new ATOM 831 N VAL A 52 31.355 -4.176 -5.414 1.00 0.00 N ATOM 832 CA VAL A 52 30.942 -5.556 -5.598 1.00 0.00 C ATOM 833 C VAL A 52 31.778 -6.229 -6.682 1.00 0.00 C ATOM 834 O VAL A 52 32.211 -5.586 -7.638 1.00 0.00 O ATOM 835 CB VAL A 52 29.450 -5.657 -5.919 1.00 0.00 C ATOM 836 CG1 VAL A 52 28.710 -6.190 -4.694 1.00 0.00 C ATOM 837 CG2 VAL A 52 28.825 -4.321 -6.331 1.00 0.00 C ATOM 0 H VAL A 52 31.352 -3.629 -6.275 1.00 0.00 H new ATOM 0 HA VAL A 52 31.111 -6.081 -4.658 1.00 0.00 H new ATOM 0 HB VAL A 52 29.355 -6.332 -6.770 1.00 0.00 H new ATOM 0 HG11 VAL A 52 27.645 -6.265 -4.916 1.00 0.00 H new ATOM 0 HG12 VAL A 52 29.097 -7.176 -4.436 1.00 0.00 H new ATOM 0 HG13 VAL A 52 28.859 -5.511 -3.855 1.00 0.00 H new ATOM 0 HG21 VAL A 52 27.766 -4.465 -6.544 1.00 0.00 H new ATOM 0 HG22 VAL A 52 28.937 -3.601 -5.520 1.00 0.00 H new ATOM 0 HG23 VAL A 52 29.327 -3.944 -7.222 1.00 0.00 H new ATOM 847 N ASN A 53 31.999 -7.535 -6.519 1.00 0.00 N ATOM 848 CA ASN A 53 32.835 -8.336 -7.402 1.00 0.00 C ATOM 849 C ASN A 53 32.095 -8.848 -8.640 1.00 0.00 C ATOM 850 O ASN A 53 30.864 -8.864 -8.695 1.00 0.00 O ATOM 851 CB ASN A 53 33.435 -9.497 -6.600 1.00 0.00 C ATOM 852 CG ASN A 53 32.399 -10.389 -5.920 1.00 0.00 C ATOM 853 OD1 ASN A 53 32.760 -11.259 -5.136 1.00 0.00 O ATOM 854 ND2 ASN A 53 31.114 -10.192 -6.200 1.00 0.00 N ATOM 0 H ASN A 53 31.592 -8.072 -5.753 1.00 0.00 H new ATOM 0 HA ASN A 53 33.627 -7.692 -7.783 1.00 0.00 H new ATOM 0 HB2 ASN A 53 34.043 -10.109 -7.267 1.00 0.00 H new ATOM 0 HB3 ASN A 53 34.104 -9.092 -5.841 1.00 0.00 H new ATOM 0 HD21 ASN A 53 30.401 -10.772 -5.758 1.00 0.00 H new ATOM 0 HD22 ASN A 53 30.841 -9.461 -6.857 1.00 0.00 H new ATOM 861 N THR A 54 32.885 -9.268 -9.635 1.00 0.00 N ATOM 862 CA THR A 54 32.400 -9.756 -10.921 1.00 0.00 C ATOM 863 C THR A 54 31.408 -10.901 -10.753 1.00 0.00 C ATOM 864 O THR A 54 30.545 -11.090 -11.607 1.00 0.00 O ATOM 865 CB THR A 54 33.592 -10.248 -11.748 1.00 0.00 C ATOM 866 OG1 THR A 54 34.250 -11.284 -11.053 1.00 0.00 O ATOM 867 CG2 THR A 54 34.578 -9.110 -12.007 1.00 0.00 C ATOM 0 H THR A 54 33.902 -9.276 -9.562 1.00 0.00 H new ATOM 0 HA THR A 54 31.888 -8.935 -11.424 1.00 0.00 H new ATOM 0 HB THR A 54 33.222 -10.616 -12.705 1.00 0.00 H new ATOM 0 HG1 THR A 54 35.012 -11.601 -11.582 1.00 0.00 H new ATOM 0 HG21 THR A 54 35.416 -9.482 -12.596 1.00 0.00 H new ATOM 0 HG22 THR A 54 34.077 -8.311 -12.554 1.00 0.00 H new ATOM 0 HG23 THR A 54 34.945 -8.724 -11.056 1.00 0.00 H new ATOM 875 N ARG A 55 31.528 -11.659 -9.660 1.00 0.00 N ATOM 876 CA ARG A 55 30.624 -12.759 -9.366 1.00 0.00 C ATOM 877 C ARG A 55 29.189 -12.249 -9.363 1.00 0.00 C ATOM 878 O ARG A 55 28.337 -12.784 -10.067 1.00 0.00 O ATOM 879 CB ARG A 55 30.964 -13.351 -7.994 1.00 0.00 C ATOM 880 CG ARG A 55 32.332 -14.044 -7.959 1.00 0.00 C ATOM 881 CD ARG A 55 32.230 -15.535 -8.291 1.00 0.00 C ATOM 882 NE ARG A 55 31.717 -15.763 -9.646 1.00 0.00 N ATOM 883 CZ ARG A 55 30.506 -16.256 -9.937 1.00 0.00 C ATOM 884 NH1 ARG A 55 29.650 -16.612 -8.981 1.00 0.00 N1+ ATOM 885 NH2 ARG A 55 30.144 -16.397 -11.210 1.00 0.00 N ATOM 0 H ARG A 55 32.256 -11.523 -8.959 1.00 0.00 H new ATOM 0 HA ARG A 55 30.732 -13.531 -10.127 1.00 0.00 H new ATOM 0 HB2 ARG A 55 30.947 -12.557 -7.248 1.00 0.00 H new ATOM 0 HB3 ARG A 55 30.193 -14.068 -7.713 1.00 0.00 H new ATOM 0 HG2 ARG A 55 33.002 -13.560 -8.670 1.00 0.00 H new ATOM 0 HG3 ARG A 55 32.774 -13.922 -6.970 1.00 0.00 H new ATOM 0 HD2 ARG A 55 33.213 -15.996 -8.193 1.00 0.00 H new ATOM 0 HD3 ARG A 55 31.576 -16.023 -7.569 1.00 0.00 H new ATOM 0 HE ARG A 55 32.330 -15.528 -10.427 1.00 0.00 H new ATOM 0 HH11 ARG A 55 29.911 -16.512 -8.000 1.00 0.00 H new ATOM 0 HH12 ARG A 55 28.734 -16.985 -9.230 1.00 0.00 H new ATOM 0 HH21 ARG A 55 30.787 -16.130 -11.956 1.00 0.00 H new ATOM 0 HH22 ARG A 55 29.224 -16.772 -11.440 1.00 0.00 H new ATOM 899 N ARG A 56 28.916 -11.210 -8.568 1.00 0.00 N ATOM 900 CA ARG A 56 27.566 -10.684 -8.444 1.00 0.00 C ATOM 901 C ARG A 56 27.167 -9.885 -9.678 1.00 0.00 C ATOM 902 O ARG A 56 25.980 -9.826 -10.003 1.00 0.00 O ATOM 903 CB ARG A 56 27.439 -9.860 -7.161 1.00 0.00 C ATOM 904 CG ARG A 56 27.695 -10.767 -5.957 1.00 0.00 C ATOM 905 CD ARG A 56 27.458 -9.994 -4.661 1.00 0.00 C ATOM 906 NE ARG A 56 27.839 -10.792 -3.488 1.00 0.00 N ATOM 907 CZ ARG A 56 27.219 -11.907 -3.073 1.00 0.00 C ATOM 908 NH1 ARG A 56 26.150 -12.390 -3.710 1.00 0.00 N1+ ATOM 909 NH2 ARG A 56 27.676 -12.553 -1.999 1.00 0.00 N ATOM 0 H ARG A 56 29.613 -10.723 -8.005 1.00 0.00 H new ATOM 0 HA ARG A 56 26.870 -11.520 -8.376 1.00 0.00 H new ATOM 0 HB2 ARG A 56 28.153 -9.037 -7.170 1.00 0.00 H new ATOM 0 HB3 ARG A 56 26.445 -9.418 -7.095 1.00 0.00 H new ATOM 0 HG2 ARG A 56 27.036 -11.635 -5.998 1.00 0.00 H new ATOM 0 HG3 ARG A 56 28.718 -11.142 -5.985 1.00 0.00 H new ATOM 0 HD2 ARG A 56 28.033 -9.068 -4.676 1.00 0.00 H new ATOM 0 HD3 ARG A 56 26.407 -9.715 -4.588 1.00 0.00 H new ATOM 0 HE ARG A 56 28.641 -10.472 -2.944 1.00 0.00 H new ATOM 0 HH11 ARG A 56 25.786 -11.909 -4.533 1.00 0.00 H new ATOM 0 HH12 ARG A 56 25.697 -13.240 -3.374 1.00 0.00 H new ATOM 0 HH21 ARG A 56 28.492 -12.199 -1.499 1.00 0.00 H new ATOM 0 HH22 ARG A 56 27.210 -13.401 -1.677 1.00 0.00 H new ATOM 923 N LYS A 57 28.128 -9.266 -10.376 1.00 0.00 N ATOM 924 CA LYS A 57 27.798 -8.608 -11.633 1.00 0.00 C ATOM 925 C LYS A 57 27.312 -9.654 -12.632 1.00 0.00 C ATOM 926 O LYS A 57 26.470 -9.346 -13.470 1.00 0.00 O ATOM 927 CB LYS A 57 28.984 -7.815 -12.186 1.00 0.00 C ATOM 928 CG LYS A 57 29.091 -6.422 -11.554 1.00 0.00 C ATOM 929 CD LYS A 57 29.709 -6.482 -10.162 1.00 0.00 C ATOM 930 CE LYS A 57 29.783 -5.098 -9.514 1.00 0.00 C ATOM 931 NZ LYS A 57 30.576 -4.152 -10.316 1.00 0.00 N1+ ATOM 0 H LYS A 57 29.108 -9.210 -10.098 1.00 0.00 H new ATOM 0 HA LYS A 57 27.001 -7.886 -11.454 1.00 0.00 H new ATOM 0 HB2 LYS A 57 29.906 -8.367 -12.003 1.00 0.00 H new ATOM 0 HB3 LYS A 57 28.881 -7.716 -13.267 1.00 0.00 H new ATOM 0 HG2 LYS A 57 29.695 -5.778 -12.193 1.00 0.00 H new ATOM 0 HG3 LYS A 57 28.100 -5.972 -11.493 1.00 0.00 H new ATOM 0 HD2 LYS A 57 29.120 -7.148 -9.531 1.00 0.00 H new ATOM 0 HD3 LYS A 57 30.711 -6.907 -10.227 1.00 0.00 H new ATOM 0 HE2 LYS A 57 28.775 -4.705 -9.383 1.00 0.00 H new ATOM 0 HE3 LYS A 57 30.222 -5.187 -8.520 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 30.929 -3.389 -9.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 31.381 -4.651 -10.746 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 29.979 -3.747 -11.065 1.00 0.00 H new ATOM 945 N LEU A 58 27.829 -10.885 -12.557 1.00 0.00 N ATOM 946 CA LEU A 58 27.384 -11.955 -13.435 1.00 0.00 C ATOM 947 C LEU A 58 25.979 -12.432 -13.055 1.00 0.00 C ATOM 948 O LEU A 58 25.184 -12.753 -13.934 1.00 0.00 O ATOM 949 CB LEU A 58 28.400 -13.097 -13.396 1.00 0.00 C ATOM 950 CG LEU A 58 28.129 -14.149 -14.475 1.00 0.00 C ATOM 951 CD1 LEU A 58 28.333 -13.567 -15.875 1.00 0.00 C ATOM 952 CD2 LEU A 58 29.107 -15.303 -14.274 1.00 0.00 C ATOM 0 H LEU A 58 28.556 -11.158 -11.895 1.00 0.00 H new ATOM 0 HA LEU A 58 27.322 -11.580 -14.456 1.00 0.00 H new ATOM 0 HB2 LEU A 58 29.404 -12.693 -13.529 1.00 0.00 H new ATOM 0 HB3 LEU A 58 28.374 -13.571 -12.415 1.00 0.00 H new ATOM 0 HG LEU A 58 27.096 -14.487 -14.390 1.00 0.00 H new ATOM 0 HD11 LEU A 58 28.134 -14.336 -16.621 1.00 0.00 H new ATOM 0 HD12 LEU A 58 27.650 -12.731 -16.024 1.00 0.00 H new ATOM 0 HD13 LEU A 58 29.361 -13.219 -15.978 1.00 0.00 H new ATOM 0 HD21 LEU A 58 28.931 -16.065 -15.033 1.00 0.00 H new ATOM 0 HD22 LEU A 58 30.129 -14.933 -14.360 1.00 0.00 H new ATOM 0 HD23 LEU A 58 28.960 -15.736 -13.284 1.00 0.00 H new ATOM 964 N LEU A 59 25.664 -12.482 -11.755 1.00 0.00 N ATOM 965 CA LEU A 59 24.324 -12.835 -11.307 1.00 0.00 C ATOM 966 C LEU A 59 23.328 -11.807 -11.814 1.00 0.00 C ATOM 967 O LEU A 59 22.350 -12.149 -12.476 1.00 0.00 O ATOM 968 CB LEU A 59 24.250 -12.858 -9.777 1.00 0.00 C ATOM 969 CG LEU A 59 25.242 -13.846 -9.185 1.00 0.00 C ATOM 970 CD1 LEU A 59 25.237 -13.722 -7.665 1.00 0.00 C ATOM 971 CD2 LEU A 59 24.876 -15.274 -9.574 1.00 0.00 C ATOM 0 H LEU A 59 26.322 -12.282 -11.001 1.00 0.00 H new ATOM 0 HA LEU A 59 24.088 -13.825 -11.698 1.00 0.00 H new ATOM 0 HB2 LEU A 59 24.452 -11.860 -9.387 1.00 0.00 H new ATOM 0 HB3 LEU A 59 23.240 -13.124 -9.465 1.00 0.00 H new ATOM 0 HG LEU A 59 26.234 -13.619 -9.575 1.00 0.00 H new ATOM 0 HD11 LEU A 59 25.948 -14.430 -7.240 1.00 0.00 H new ATOM 0 HD12 LEU A 59 25.521 -12.708 -7.382 1.00 0.00 H new ATOM 0 HD13 LEU A 59 24.238 -13.939 -7.286 1.00 0.00 H new ATOM 0 HD21 LEU A 59 25.598 -15.966 -9.140 1.00 0.00 H new ATOM 0 HD22 LEU A 59 23.879 -15.509 -9.200 1.00 0.00 H new ATOM 0 HD23 LEU A 59 24.888 -15.370 -10.660 1.00 0.00 H new ATOM 983 N GLY A 60 23.591 -10.539 -11.494 1.00 0.00 N ATOM 984 CA GLY A 60 22.763 -9.441 -11.958 1.00 0.00 C ATOM 985 C GLY A 60 22.633 -9.403 -13.481 1.00 0.00 C ATOM 986 O GLY A 60 21.616 -8.941 -13.999 1.00 0.00 O ATOM 0 H GLY A 60 24.378 -10.253 -10.911 1.00 0.00 H new ATOM 0 HA2 GLY A 60 21.771 -9.527 -11.515 1.00 0.00 H new ATOM 0 HA3 GLY A 60 23.187 -8.499 -11.610 1.00 0.00 H new ATOM 990 N LEU A 61 23.653 -9.885 -14.198 1.00 0.00 N ATOM 991 CA LEU A 61 23.621 -9.989 -15.648 1.00 0.00 C ATOM 992 C LEU A 61 22.653 -11.091 -16.083 1.00 0.00 C ATOM 993 O LEU A 61 21.814 -10.867 -16.952 1.00 0.00 O ATOM 994 CB LEU A 61 25.062 -10.209 -16.138 1.00 0.00 C ATOM 995 CG LEU A 61 25.251 -10.333 -17.656 1.00 0.00 C ATOM 996 CD1 LEU A 61 24.859 -11.706 -18.196 1.00 0.00 C ATOM 997 CD2 LEU A 61 24.481 -9.247 -18.395 1.00 0.00 C ATOM 0 H LEU A 61 24.524 -10.213 -13.781 1.00 0.00 H new ATOM 0 HA LEU A 61 23.244 -9.074 -16.104 1.00 0.00 H new ATOM 0 HB2 LEU A 61 25.675 -9.380 -15.783 1.00 0.00 H new ATOM 0 HB3 LEU A 61 25.448 -11.114 -15.670 1.00 0.00 H new ATOM 0 HG LEU A 61 26.318 -10.206 -17.837 1.00 0.00 H new ATOM 0 HD11 LEU A 61 25.015 -11.731 -19.274 1.00 0.00 H new ATOM 0 HD12 LEU A 61 25.473 -12.472 -17.723 1.00 0.00 H new ATOM 0 HD13 LEU A 61 23.808 -11.897 -17.977 1.00 0.00 H new ATOM 0 HD21 LEU A 61 24.633 -9.359 -19.468 1.00 0.00 H new ATOM 0 HD22 LEU A 61 23.419 -9.336 -18.168 1.00 0.00 H new ATOM 0 HD23 LEU A 61 24.839 -8.267 -18.078 1.00 0.00 H new ATOM 1009 N TYR A 62 22.765 -12.282 -15.487 1.00 0.00 N ATOM 1010 CA TYR A 62 21.849 -13.377 -15.778 1.00 0.00 C ATOM 1011 C TYR A 62 20.426 -13.006 -15.367 1.00 0.00 C ATOM 1012 O TYR A 62 19.461 -13.427 -16.004 1.00 0.00 O ATOM 1013 CB TYR A 62 22.279 -14.633 -15.013 1.00 0.00 C ATOM 1014 CG TYR A 62 23.601 -15.254 -15.414 1.00 0.00 C ATOM 1015 CD1 TYR A 62 24.216 -16.156 -14.534 1.00 0.00 C ATOM 1016 CD2 TYR A 62 24.210 -14.951 -16.642 1.00 0.00 C ATOM 1017 CE1 TYR A 62 25.424 -16.773 -14.883 1.00 0.00 C ATOM 1018 CE2 TYR A 62 25.420 -15.562 -17.001 1.00 0.00 C ATOM 1019 CZ TYR A 62 26.025 -16.486 -16.124 1.00 0.00 C ATOM 1020 OH TYR A 62 27.193 -17.095 -16.481 1.00 0.00 O ATOM 0 H TYR A 62 23.484 -12.508 -14.800 1.00 0.00 H new ATOM 0 HA TYR A 62 21.874 -13.571 -16.850 1.00 0.00 H new ATOM 0 HB2 TYR A 62 22.327 -14.386 -13.952 1.00 0.00 H new ATOM 0 HB3 TYR A 62 21.500 -15.386 -15.130 1.00 0.00 H new ATOM 0 HD1 TYR A 62 23.756 -16.376 -13.582 1.00 0.00 H new ATOM 0 HD2 TYR A 62 23.745 -14.244 -17.313 1.00 0.00 H new ATOM 0 HE1 TYR A 62 25.894 -17.467 -14.202 1.00 0.00 H new ATOM 0 HE2 TYR A 62 25.887 -15.326 -17.946 1.00 0.00 H new ATOM 0 HH TYR A 62 27.467 -16.783 -17.369 1.00 0.00 H new ATOM 1030 N LEU A 63 20.292 -12.215 -14.300 1.00 0.00 N ATOM 1031 CA LEU A 63 19.001 -11.740 -13.842 1.00 0.00 C ATOM 1032 C LEU A 63 18.364 -10.835 -14.881 1.00 0.00 C ATOM 1033 O LEU A 63 17.206 -11.032 -15.244 1.00 0.00 O ATOM 1034 CB LEU A 63 19.182 -11.017 -12.511 1.00 0.00 C ATOM 1035 CG LEU A 63 17.892 -10.370 -12.013 1.00 0.00 C ATOM 1036 CD1 LEU A 63 16.764 -11.392 -11.911 1.00 0.00 C ATOM 1037 CD2 LEU A 63 18.167 -9.801 -10.626 1.00 0.00 C ATOM 0 H LEU A 63 21.078 -11.891 -13.736 1.00 0.00 H new ATOM 0 HA LEU A 63 18.329 -12.586 -13.696 1.00 0.00 H new ATOM 0 HB2 LEU A 63 19.541 -11.724 -11.764 1.00 0.00 H new ATOM 0 HB3 LEU A 63 19.950 -10.251 -12.620 1.00 0.00 H new ATOM 0 HG LEU A 63 17.584 -9.594 -12.714 1.00 0.00 H new ATOM 0 HD11 LEU A 63 15.859 -10.901 -11.554 1.00 0.00 H new ATOM 0 HD12 LEU A 63 16.577 -11.827 -12.893 1.00 0.00 H new ATOM 0 HD13 LEU A 63 17.049 -12.180 -11.213 1.00 0.00 H new ATOM 0 HD21 LEU A 63 17.263 -9.330 -10.240 1.00 0.00 H new ATOM 0 HD22 LEU A 63 18.471 -10.606 -9.956 1.00 0.00 H new ATOM 0 HD23 LEU A 63 18.964 -9.060 -10.688 1.00 0.00 H new ATOM 1049 N MET A 64 19.111 -9.842 -15.366 1.00 0.00 N ATOM 1050 CA MET A 64 18.584 -8.963 -16.389 1.00 0.00 C ATOM 1051 C MET A 64 18.175 -9.803 -17.591 1.00 0.00 C ATOM 1052 O MET A 64 17.112 -9.580 -18.161 1.00 0.00 O ATOM 1053 CB MET A 64 19.646 -7.937 -16.787 1.00 0.00 C ATOM 1054 CG MET A 64 19.206 -7.127 -18.011 1.00 0.00 C ATOM 1055 SD MET A 64 20.548 -6.457 -19.026 1.00 0.00 S ATOM 1056 CE MET A 64 21.303 -8.006 -19.579 1.00 0.00 C ATOM 0 H MET A 64 20.064 -9.635 -15.068 1.00 0.00 H new ATOM 0 HA MET A 64 17.714 -8.426 -16.011 1.00 0.00 H new ATOM 0 HB2 MET A 64 19.835 -7.263 -15.951 1.00 0.00 H new ATOM 0 HB3 MET A 64 20.584 -8.447 -17.004 1.00 0.00 H new ATOM 0 HG2 MET A 64 18.581 -7.761 -18.639 1.00 0.00 H new ATOM 0 HG3 MET A 64 18.582 -6.300 -17.672 1.00 0.00 H new ATOM 0 HE1 MET A 64 22.386 -7.889 -19.620 1.00 0.00 H new ATOM 0 HE2 MET A 64 21.051 -8.803 -18.880 1.00 0.00 H new ATOM 0 HE3 MET A 64 20.928 -8.260 -20.570 1.00 0.00 H new ATOM 1066 N ASN A 65 19.024 -10.765 -17.967 1.00 0.00 N ATOM 1067 CA ASN A 65 18.798 -11.604 -19.127 1.00 0.00 C ATOM 1068 C ASN A 65 17.443 -12.296 -19.041 1.00 0.00 C ATOM 1069 O ASN A 65 16.674 -12.243 -20.000 1.00 0.00 O ATOM 1070 CB ASN A 65 19.941 -12.615 -19.212 1.00 0.00 C ATOM 1071 CG ASN A 65 19.650 -13.761 -20.169 1.00 0.00 C ATOM 1072 OD1 ASN A 65 19.788 -14.923 -19.795 1.00 0.00 O ATOM 1073 ND2 ASN A 65 19.248 -13.445 -21.396 1.00 0.00 N ATOM 0 H ASN A 65 19.888 -10.977 -17.467 1.00 0.00 H new ATOM 0 HA ASN A 65 18.781 -10.997 -20.032 1.00 0.00 H new ATOM 0 HB2 ASN A 65 20.849 -12.103 -19.532 1.00 0.00 H new ATOM 0 HB3 ASN A 65 20.136 -13.019 -18.219 1.00 0.00 H new ATOM 0 HD21 ASN A 65 19.040 -14.182 -22.070 1.00 0.00 H new ATOM 0 HD22 ASN A 65 19.147 -12.466 -21.663 1.00 0.00 H new ATOM 1080 N HIS A 66 17.135 -12.943 -17.915 1.00 0.00 N ATOM 1081 CA HIS A 66 15.846 -13.598 -17.765 1.00 0.00 C ATOM 1082 C HIS A 66 14.710 -12.584 -17.701 1.00 0.00 C ATOM 1083 O HIS A 66 13.659 -12.818 -18.293 1.00 0.00 O ATOM 1084 CB HIS A 66 15.854 -14.493 -16.522 1.00 0.00 C ATOM 1085 CG HIS A 66 16.589 -15.796 -16.720 1.00 0.00 C ATOM 1086 ND1 HIS A 66 16.650 -16.829 -15.782 1.00 0.00 N ATOM 1087 CD2 HIS A 66 17.289 -16.162 -17.837 1.00 0.00 C ATOM 1088 CE1 HIS A 66 17.372 -17.798 -16.371 1.00 0.00 C ATOM 1089 NE2 HIS A 66 17.762 -17.429 -17.604 1.00 0.00 N ATOM 0 H HIS A 66 17.754 -13.024 -17.108 1.00 0.00 H new ATOM 0 HA HIS A 66 15.674 -14.220 -18.643 1.00 0.00 H new ATOM 0 HB2 HIS A 66 16.312 -13.949 -15.696 1.00 0.00 H new ATOM 0 HB3 HIS A 66 14.825 -14.706 -16.232 1.00 0.00 H new ATOM 0 HD2 HIS A 66 17.440 -15.570 -18.728 1.00 0.00 H new ATOM 0 HE1 HIS A 66 17.608 -18.748 -15.914 1.00 0.00 H new ATOM 0 HE2 HIS A 66 18.313 -17.992 -18.252 1.00 0.00 H new ATOM 1097 N VAL A 67 14.891 -11.464 -16.996 1.00 0.00 N ATOM 1098 CA VAL A 67 13.832 -10.469 -16.860 1.00 0.00 C ATOM 1099 C VAL A 67 13.449 -9.868 -18.211 1.00 0.00 C ATOM 1100 O VAL A 67 12.262 -9.787 -18.520 1.00 0.00 O ATOM 1101 CB VAL A 67 14.279 -9.387 -15.878 1.00 0.00 C ATOM 1102 CG1 VAL A 67 13.305 -8.215 -15.890 1.00 0.00 C ATOM 1103 CG2 VAL A 67 14.300 -9.950 -14.459 1.00 0.00 C ATOM 0 H VAL A 67 15.758 -11.227 -16.514 1.00 0.00 H new ATOM 0 HA VAL A 67 12.939 -10.958 -16.470 1.00 0.00 H new ATOM 0 HB VAL A 67 15.272 -9.054 -16.180 1.00 0.00 H new ATOM 0 HG11 VAL A 67 13.641 -7.455 -15.184 1.00 0.00 H new ATOM 0 HG12 VAL A 67 13.263 -7.787 -16.891 1.00 0.00 H new ATOM 0 HG13 VAL A 67 12.313 -8.563 -15.603 1.00 0.00 H new ATOM 0 HG21 VAL A 67 14.620 -9.173 -13.764 1.00 0.00 H new ATOM 0 HG22 VAL A 67 13.301 -10.291 -14.188 1.00 0.00 H new ATOM 0 HG23 VAL A 67 14.995 -10.788 -14.410 1.00 0.00 H new ATOM 1113 N VAL A 68 14.424 -9.448 -19.024 1.00 0.00 N ATOM 1114 CA VAL A 68 14.105 -8.845 -20.314 1.00 0.00 C ATOM 1115 C VAL A 68 13.535 -9.885 -21.271 1.00 0.00 C ATOM 1116 O VAL A 68 12.694 -9.560 -22.107 1.00 0.00 O ATOM 1117 CB VAL A 68 15.333 -8.160 -20.923 1.00 0.00 C ATOM 1118 CG1 VAL A 68 15.875 -7.098 -19.966 1.00 0.00 C ATOM 1119 CG2 VAL A 68 16.433 -9.156 -21.288 1.00 0.00 C ATOM 0 H VAL A 68 15.420 -9.514 -18.814 1.00 0.00 H new ATOM 0 HA VAL A 68 13.345 -8.082 -20.148 1.00 0.00 H new ATOM 0 HB VAL A 68 15.011 -7.683 -21.849 1.00 0.00 H new ATOM 0 HG11 VAL A 68 16.747 -6.619 -20.411 1.00 0.00 H new ATOM 0 HG12 VAL A 68 15.105 -6.349 -19.780 1.00 0.00 H new ATOM 0 HG13 VAL A 68 16.160 -7.568 -19.025 1.00 0.00 H new ATOM 0 HG21 VAL A 68 17.281 -8.621 -21.716 1.00 0.00 H new ATOM 0 HG22 VAL A 68 16.754 -9.688 -20.392 1.00 0.00 H new ATOM 0 HG23 VAL A 68 16.050 -9.870 -22.017 1.00 0.00 H new ATOM 1129 N GLN A 69 13.984 -11.137 -21.154 1.00 0.00 N ATOM 1130 CA GLN A 69 13.469 -12.213 -21.981 1.00 0.00 C ATOM 1131 C GLN A 69 12.045 -12.582 -21.585 1.00 0.00 C ATOM 1132 O GLN A 69 11.207 -12.774 -22.459 1.00 0.00 O ATOM 1133 CB GLN A 69 14.370 -13.442 -21.858 1.00 0.00 C ATOM 1134 CG GLN A 69 15.623 -13.260 -22.719 1.00 0.00 C ATOM 1135 CD GLN A 69 16.558 -14.457 -22.610 1.00 0.00 C ATOM 1136 OE1 GLN A 69 16.485 -15.232 -21.663 1.00 0.00 O ATOM 1137 NE2 GLN A 69 17.450 -14.619 -23.584 1.00 0.00 N ATOM 0 H GLN A 69 14.704 -11.423 -20.491 1.00 0.00 H new ATOM 0 HA GLN A 69 13.458 -11.867 -23.015 1.00 0.00 H new ATOM 0 HB2 GLN A 69 14.653 -13.593 -20.816 1.00 0.00 H new ATOM 0 HB3 GLN A 69 13.828 -14.334 -22.173 1.00 0.00 H new ATOM 0 HG2 GLN A 69 15.332 -13.119 -23.760 1.00 0.00 H new ATOM 0 HG3 GLN A 69 16.150 -12.357 -22.410 1.00 0.00 H new ATOM 0 HE21 GLN A 69 17.485 -13.956 -24.359 1.00 0.00 H new ATOM 0 HE22 GLN A 69 18.098 -15.406 -23.556 1.00 0.00 H new ATOM 1146 N GLN A 70 11.752 -12.686 -20.287 1.00 0.00 N ATOM 1147 CA GLN A 70 10.399 -13.007 -19.871 1.00 0.00 C ATOM 1148 C GLN A 70 9.483 -11.815 -20.120 1.00 0.00 C ATOM 1149 O GLN A 70 8.306 -11.997 -20.420 1.00 0.00 O ATOM 1150 CB GLN A 70 10.369 -13.404 -18.395 1.00 0.00 C ATOM 1151 CG GLN A 70 11.155 -14.693 -18.148 1.00 0.00 C ATOM 1152 CD GLN A 70 11.269 -14.984 -16.657 1.00 0.00 C ATOM 1153 OE1 GLN A 70 12.330 -14.827 -16.060 1.00 0.00 O ATOM 1154 NE2 GLN A 70 10.168 -15.415 -16.041 1.00 0.00 N ATOM 0 H GLN A 70 12.420 -12.555 -19.527 1.00 0.00 H new ATOM 0 HA GLN A 70 10.044 -13.854 -20.458 1.00 0.00 H new ATOM 0 HB2 GLN A 70 10.788 -12.599 -17.791 1.00 0.00 H new ATOM 0 HB3 GLN A 70 9.336 -13.539 -18.074 1.00 0.00 H new ATOM 0 HG2 GLN A 70 10.661 -15.526 -18.648 1.00 0.00 H new ATOM 0 HG3 GLN A 70 12.151 -14.605 -18.582 1.00 0.00 H new ATOM 0 HE21 GLN A 70 9.303 -15.534 -16.568 1.00 0.00 H new ATOM 0 HE22 GLN A 70 10.191 -15.625 -15.043 1.00 0.00 H new ATOM 1163 N ALA A 71 10.011 -10.591 -20.002 1.00 0.00 N ATOM 1164 CA ALA A 71 9.251 -9.391 -20.320 1.00 0.00 C ATOM 1165 C ALA A 71 8.806 -9.465 -21.776 1.00 0.00 C ATOM 1166 O ALA A 71 7.627 -9.286 -22.077 1.00 0.00 O ATOM 1167 CB ALA A 71 10.140 -8.169 -20.099 1.00 0.00 C ATOM 0 H ALA A 71 10.965 -10.412 -19.687 1.00 0.00 H new ATOM 0 HA ALA A 71 8.372 -9.312 -19.680 1.00 0.00 H new ATOM 0 HB1 ALA A 71 9.580 -7.264 -20.335 1.00 0.00 H new ATOM 0 HB2 ALA A 71 10.461 -8.136 -19.058 1.00 0.00 H new ATOM 0 HB3 ALA A 71 11.014 -8.233 -20.747 1.00 0.00 H new ATOM 1173 N LYS A 72 9.773 -9.731 -22.659 1.00 0.00 N ATOM 1174 CA LYS A 72 9.543 -10.009 -24.071 1.00 0.00 C ATOM 1175 C LYS A 72 8.567 -11.171 -24.248 1.00 0.00 C ATOM 1176 O LYS A 72 7.749 -11.157 -25.163 1.00 0.00 O ATOM 1177 CB LYS A 72 10.895 -10.370 -24.695 1.00 0.00 C ATOM 1178 CG LYS A 72 10.792 -10.792 -26.160 1.00 0.00 C ATOM 1179 CD LYS A 72 10.668 -9.562 -27.052 1.00 0.00 C ATOM 1180 CE LYS A 72 10.751 -10.001 -28.510 1.00 0.00 C ATOM 1181 NZ LYS A 72 10.728 -8.841 -29.419 1.00 0.00 N1+ ATOM 0 H LYS A 72 10.759 -9.759 -22.401 1.00 0.00 H new ATOM 0 HA LYS A 72 9.107 -9.135 -24.555 1.00 0.00 H new ATOM 0 HB2 LYS A 72 11.563 -9.513 -24.617 1.00 0.00 H new ATOM 0 HB3 LYS A 72 11.347 -11.180 -24.122 1.00 0.00 H new ATOM 0 HG2 LYS A 72 11.672 -11.369 -26.443 1.00 0.00 H new ATOM 0 HG3 LYS A 72 9.927 -11.441 -26.300 1.00 0.00 H new ATOM 0 HD2 LYS A 72 9.722 -9.054 -26.864 1.00 0.00 H new ATOM 0 HD3 LYS A 72 11.462 -8.851 -26.826 1.00 0.00 H new ATOM 0 HE2 LYS A 72 11.666 -10.572 -28.669 1.00 0.00 H new ATOM 0 HE3 LYS A 72 9.917 -10.664 -28.741 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 10.988 -9.147 -30.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 9.773 -8.430 -29.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 11.407 -8.127 -29.087 1.00 0.00 H new ATOM 1195 N GLY A 73 8.654 -12.176 -23.372 1.00 0.00 N ATOM 1196 CA GLY A 73 7.811 -13.360 -23.423 1.00 0.00 C ATOM 1197 C GLY A 73 6.335 -13.005 -23.321 1.00 0.00 C ATOM 1198 O GLY A 73 5.562 -13.296 -24.232 1.00 0.00 O ATOM 0 H GLY A 73 9.322 -12.184 -22.601 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.993 -13.896 -24.354 1.00 0.00 H new ATOM 0 HA3 GLY A 73 8.080 -14.034 -22.610 1.00 0.00 H new ATOM 1202 N GLN A 74 5.943 -12.380 -22.209 1.00 0.00 N ATOM 1203 CA GLN A 74 4.561 -11.986 -21.982 1.00 0.00 C ATOM 1204 C GLN A 74 4.241 -10.669 -22.684 1.00 0.00 C ATOM 1205 O GLN A 74 3.754 -10.674 -23.812 1.00 0.00 O ATOM 1206 CB GLN A 74 4.245 -11.951 -20.478 1.00 0.00 C ATOM 1207 CG GLN A 74 5.484 -11.597 -19.650 1.00 0.00 C ATOM 1208 CD GLN A 74 5.175 -11.257 -18.197 1.00 0.00 C ATOM 1209 OE1 GLN A 74 4.053 -10.903 -17.841 1.00 0.00 O ATOM 1210 NE2 GLN A 74 6.196 -11.365 -17.347 1.00 0.00 N ATOM 0 H GLN A 74 6.575 -12.136 -21.447 1.00 0.00 H new ATOM 0 HA GLN A 74 3.907 -12.737 -22.425 1.00 0.00 H new ATOM 0 HB2 GLN A 74 3.459 -11.221 -20.288 1.00 0.00 H new ATOM 0 HB3 GLN A 74 3.862 -12.922 -20.163 1.00 0.00 H new ATOM 0 HG2 GLN A 74 6.180 -12.436 -19.677 1.00 0.00 H new ATOM 0 HG3 GLN A 74 5.989 -10.749 -20.113 1.00 0.00 H new ATOM 0 HE21 GLN A 74 7.111 -11.662 -17.685 1.00 0.00 H new ATOM 0 HE22 GLN A 74 6.062 -11.150 -16.359 1.00 0.00 H new ATOM 1219 N LYS A 75 4.512 -9.538 -22.019 1.00 0.00 N ATOM 1220 CA LYS A 75 4.153 -8.217 -22.534 1.00 0.00 C ATOM 1221 C LYS A 75 4.716 -7.068 -21.689 1.00 0.00 C ATOM 1222 O LYS A 75 4.252 -5.937 -21.815 1.00 0.00 O ATOM 1223 CB LYS A 75 2.624 -8.089 -22.662 1.00 0.00 C ATOM 1224 CG LYS A 75 1.801 -8.852 -21.612 1.00 0.00 C ATOM 1225 CD LYS A 75 2.184 -8.547 -20.163 1.00 0.00 C ATOM 1226 CE LYS A 75 1.290 -9.391 -19.253 1.00 0.00 C ATOM 1227 NZ LYS A 75 1.756 -9.364 -17.856 1.00 0.00 N1+ ATOM 0 H LYS A 75 4.983 -9.516 -21.115 1.00 0.00 H new ATOM 0 HA LYS A 75 4.610 -8.132 -23.520 1.00 0.00 H new ATOM 0 HB2 LYS A 75 2.360 -7.033 -22.606 1.00 0.00 H new ATOM 0 HB3 LYS A 75 2.330 -8.439 -23.652 1.00 0.00 H new ATOM 0 HG2 LYS A 75 0.746 -8.616 -21.753 1.00 0.00 H new ATOM 0 HG3 LYS A 75 1.914 -9.922 -21.787 1.00 0.00 H new ATOM 0 HD2 LYS A 75 3.234 -8.780 -19.989 1.00 0.00 H new ATOM 0 HD3 LYS A 75 2.053 -7.486 -19.949 1.00 0.00 H new ATOM 0 HE2 LYS A 75 0.266 -9.020 -19.303 1.00 0.00 H new ATOM 0 HE3 LYS A 75 1.274 -10.420 -19.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 1.071 -9.862 -17.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 2.682 -9.834 -17.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 1.845 -8.378 -17.539 1.00 0.00 H new ATOM 1241 N ILE A 76 5.707 -7.322 -20.828 1.00 0.00 N ATOM 1242 CA ILE A 76 6.224 -6.284 -19.937 1.00 0.00 C ATOM 1243 C ILE A 76 7.247 -5.408 -20.667 1.00 0.00 C ATOM 1244 O ILE A 76 8.397 -5.307 -20.244 1.00 0.00 O ATOM 1245 CB ILE A 76 6.808 -6.890 -18.651 1.00 0.00 C ATOM 1246 CG1 ILE A 76 5.910 -7.975 -18.047 1.00 0.00 C ATOM 1247 CG2 ILE A 76 7.021 -5.777 -17.616 1.00 0.00 C ATOM 1248 CD1 ILE A 76 4.535 -7.455 -17.632 1.00 0.00 C ATOM 0 H ILE A 76 6.162 -8.230 -20.731 1.00 0.00 H new ATOM 0 HA ILE A 76 5.392 -5.646 -19.639 1.00 0.00 H new ATOM 0 HB ILE A 76 7.755 -7.361 -18.916 1.00 0.00 H new ATOM 0 HG12 ILE A 76 5.784 -8.779 -18.773 1.00 0.00 H new ATOM 0 HG13 ILE A 76 6.406 -8.406 -17.177 1.00 0.00 H new ATOM 0 HG21 ILE A 76 7.435 -6.204 -16.703 1.00 0.00 H new ATOM 0 HG22 ILE A 76 7.713 -5.036 -18.016 1.00 0.00 H new ATOM 0 HG23 ILE A 76 6.067 -5.300 -17.393 1.00 0.00 H new ATOM 0 HD11 ILE A 76 3.948 -8.272 -17.212 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.653 -6.671 -16.884 1.00 0.00 H new ATOM 0 HD13 ILE A 76 4.021 -7.050 -18.504 1.00 0.00 H new ATOM 1260 N ILE A 77 6.839 -4.767 -21.767 1.00 0.00 N ATOM 1261 CA ILE A 77 7.741 -3.948 -22.569 1.00 0.00 C ATOM 1262 C ILE A 77 8.430 -2.871 -21.730 1.00 0.00 C ATOM 1263 O ILE A 77 9.469 -2.349 -22.134 1.00 0.00 O ATOM 1264 CB ILE A 77 6.986 -3.341 -23.759 1.00 0.00 C ATOM 1265 CG1 ILE A 77 5.877 -2.370 -23.335 1.00 0.00 C ATOM 1266 CG2 ILE A 77 6.381 -4.458 -24.613 1.00 0.00 C ATOM 1267 CD1 ILE A 77 6.386 -0.932 -23.228 1.00 0.00 C ATOM 0 H ILE A 77 5.883 -4.803 -22.120 1.00 0.00 H new ATOM 0 HA ILE A 77 8.531 -4.592 -22.955 1.00 0.00 H new ATOM 0 HB ILE A 77 7.714 -2.769 -24.334 1.00 0.00 H new ATOM 0 HG12 ILE A 77 5.061 -2.413 -24.057 1.00 0.00 H new ATOM 0 HG13 ILE A 77 5.469 -2.683 -22.374 1.00 0.00 H new ATOM 0 HG21 ILE A 77 5.846 -4.022 -25.457 1.00 0.00 H new ATOM 0 HG22 ILE A 77 7.177 -5.105 -24.983 1.00 0.00 H new ATOM 0 HG23 ILE A 77 5.689 -5.044 -24.008 1.00 0.00 H new ATOM 0 HD11 ILE A 77 5.568 -0.278 -22.925 1.00 0.00 H new ATOM 0 HD12 ILE A 77 7.184 -0.883 -22.487 1.00 0.00 H new ATOM 0 HD13 ILE A 77 6.770 -0.609 -24.196 1.00 0.00 H new ATOM 1279 N GLN A 78 7.863 -2.532 -20.569 1.00 0.00 N ATOM 1280 CA GLN A 78 8.451 -1.546 -19.680 1.00 0.00 C ATOM 1281 C GLN A 78 9.801 -2.027 -19.161 1.00 0.00 C ATOM 1282 O GLN A 78 10.704 -1.215 -18.968 1.00 0.00 O ATOM 1283 CB GLN A 78 7.513 -1.274 -18.498 1.00 0.00 C ATOM 1284 CG GLN A 78 6.169 -0.687 -18.943 1.00 0.00 C ATOM 1285 CD GLN A 78 5.232 -1.724 -19.552 1.00 0.00 C ATOM 1286 OE1 GLN A 78 5.431 -2.926 -19.402 1.00 0.00 O ATOM 1287 NE2 GLN A 78 4.198 -1.265 -20.248 1.00 0.00 N ATOM 0 H GLN A 78 6.990 -2.934 -20.227 1.00 0.00 H new ATOM 0 HA GLN A 78 8.599 -0.624 -20.243 1.00 0.00 H new ATOM 0 HB2 GLN A 78 7.339 -2.203 -17.954 1.00 0.00 H new ATOM 0 HB3 GLN A 78 7.996 -0.585 -17.805 1.00 0.00 H new ATOM 0 HG2 GLN A 78 5.680 -0.225 -18.085 1.00 0.00 H new ATOM 0 HG3 GLN A 78 6.349 0.103 -19.672 1.00 0.00 H new ATOM 0 HE21 GLN A 78 4.060 -0.260 -20.354 1.00 0.00 H new ATOM 0 HE22 GLN A 78 3.541 -1.918 -20.676 1.00 0.00 H new ATOM 1296 N PHE A 79 9.951 -3.337 -18.935 1.00 0.00 N ATOM 1297 CA PHE A 79 11.160 -3.894 -18.353 1.00 0.00 C ATOM 1298 C PHE A 79 12.266 -4.058 -19.384 1.00 0.00 C ATOM 1299 O PHE A 79 13.409 -3.700 -19.105 1.00 0.00 O ATOM 1300 CB PHE A 79 10.837 -5.226 -17.682 1.00 0.00 C ATOM 1301 CG PHE A 79 11.012 -5.143 -16.180 1.00 0.00 C ATOM 1302 CD1 PHE A 79 9.914 -4.846 -15.359 1.00 0.00 C ATOM 1303 CD2 PHE A 79 12.274 -5.360 -15.610 1.00 0.00 C ATOM 1304 CE1 PHE A 79 10.084 -4.770 -13.970 1.00 0.00 C ATOM 1305 CE2 PHE A 79 12.436 -5.308 -14.217 1.00 0.00 C ATOM 1306 CZ PHE A 79 11.341 -5.009 -13.399 1.00 0.00 C ATOM 0 H PHE A 79 9.236 -4.032 -19.152 1.00 0.00 H new ATOM 0 HA PHE A 79 11.531 -3.194 -17.604 1.00 0.00 H new ATOM 0 HB2 PHE A 79 9.812 -5.514 -17.915 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.486 -6.004 -18.083 1.00 0.00 H new ATOM 0 HD1 PHE A 79 8.941 -4.676 -15.796 1.00 0.00 H new ATOM 0 HD2 PHE A 79 13.123 -5.568 -16.244 1.00 0.00 H new ATOM 0 HE1 PHE A 79 9.243 -4.526 -13.337 1.00 0.00 H new ATOM 0 HE2 PHE A 79 13.404 -5.498 -13.777 1.00 0.00 H new ATOM 0 HZ PHE A 79 11.465 -4.962 -12.327 1.00 0.00 H new ATOM 1316 N GLN A 80 11.942 -4.592 -20.566 1.00 0.00 N ATOM 1317 CA GLN A 80 12.956 -4.766 -21.591 1.00 0.00 C ATOM 1318 C GLN A 80 13.456 -3.404 -22.061 1.00 0.00 C ATOM 1319 O GLN A 80 14.604 -3.287 -22.484 1.00 0.00 O ATOM 1320 CB GLN A 80 12.417 -5.636 -22.731 1.00 0.00 C ATOM 1321 CG GLN A 80 11.346 -4.930 -23.558 1.00 0.00 C ATOM 1322 CD GLN A 80 10.367 -5.922 -24.169 1.00 0.00 C ATOM 1323 OE1 GLN A 80 9.794 -6.753 -23.469 1.00 0.00 O ATOM 1324 NE2 GLN A 80 10.162 -5.843 -25.482 1.00 0.00 N ATOM 0 H GLN A 80 11.006 -4.903 -20.826 1.00 0.00 H new ATOM 0 HA GLN A 80 13.815 -5.295 -21.179 1.00 0.00 H new ATOM 0 HB2 GLN A 80 13.242 -5.924 -23.383 1.00 0.00 H new ATOM 0 HB3 GLN A 80 12.002 -6.555 -22.316 1.00 0.00 H new ATOM 0 HG2 GLN A 80 10.805 -4.225 -22.928 1.00 0.00 H new ATOM 0 HG3 GLN A 80 11.820 -4.351 -24.350 1.00 0.00 H new ATOM 0 HE21 GLN A 80 10.655 -5.141 -26.034 1.00 0.00 H new ATOM 0 HE22 GLN A 80 9.512 -6.485 -25.936 1.00 0.00 H new ATOM 1333 N ASP A 81 12.610 -2.370 -21.991 1.00 0.00 N ATOM 1334 CA ASP A 81 13.057 -1.017 -22.257 1.00 0.00 C ATOM 1335 C ASP A 81 13.915 -0.511 -21.105 1.00 0.00 C ATOM 1336 O ASP A 81 15.039 -0.068 -21.319 1.00 0.00 O ATOM 1337 CB ASP A 81 11.862 -0.076 -22.418 1.00 0.00 C ATOM 1338 CG ASP A 81 12.333 1.345 -22.721 1.00 0.00 C ATOM 1339 OD1 ASP A 81 13.426 1.481 -23.313 1.00 0.00 O ATOM 1340 OD2 ASP A 81 11.600 2.290 -22.358 1.00 0.00 O1- ATOM 0 H ASP A 81 11.621 -2.453 -21.754 1.00 0.00 H new ATOM 0 HA ASP A 81 13.638 -1.033 -23.179 1.00 0.00 H new ATOM 0 HB2 ASP A 81 11.219 -0.431 -23.223 1.00 0.00 H new ATOM 0 HB3 ASP A 81 11.264 -0.080 -21.507 1.00 0.00 H new ATOM 1345 N SER A 82 13.390 -0.572 -19.876 1.00 0.00 N ATOM 1346 CA SER A 82 14.064 0.008 -18.725 1.00 0.00 C ATOM 1347 C SER A 82 15.465 -0.561 -18.544 1.00 0.00 C ATOM 1348 O SER A 82 16.364 0.168 -18.132 1.00 0.00 O ATOM 1349 CB SER A 82 13.226 -0.199 -17.464 1.00 0.00 C ATOM 1350 OG SER A 82 11.978 0.441 -17.597 1.00 0.00 O ATOM 0 H SER A 82 12.499 -1.019 -19.660 1.00 0.00 H new ATOM 0 HA SER A 82 14.172 1.078 -18.905 1.00 0.00 H new ATOM 0 HB2 SER A 82 13.079 -1.265 -17.287 1.00 0.00 H new ATOM 0 HB3 SER A 82 13.756 0.198 -16.598 1.00 0.00 H new ATOM 0 HG SER A 82 11.308 -0.208 -17.897 1.00 0.00 H new ATOM 1356 N PHE A 83 15.670 -1.846 -18.842 1.00 0.00 N ATOM 1357 CA PHE A 83 17.003 -2.416 -18.763 1.00 0.00 C ATOM 1358 C PHE A 83 17.770 -2.237 -20.065 1.00 0.00 C ATOM 1359 O PHE A 83 18.982 -2.039 -20.029 1.00 0.00 O ATOM 1360 CB PHE A 83 16.923 -3.899 -18.384 1.00 0.00 C ATOM 1361 CG PHE A 83 16.512 -4.213 -16.960 1.00 0.00 C ATOM 1362 CD1 PHE A 83 16.369 -5.551 -16.569 1.00 0.00 C ATOM 1363 CD2 PHE A 83 16.278 -3.193 -16.026 1.00 0.00 C ATOM 1364 CE1 PHE A 83 16.038 -5.874 -15.247 1.00 0.00 C ATOM 1365 CE2 PHE A 83 15.932 -3.516 -14.705 1.00 0.00 C ATOM 1366 CZ PHE A 83 15.825 -4.854 -14.313 1.00 0.00 C ATOM 0 H PHE A 83 14.940 -2.496 -19.134 1.00 0.00 H new ATOM 0 HA PHE A 83 17.549 -1.880 -17.987 1.00 0.00 H new ATOM 0 HB2 PHE A 83 16.217 -4.385 -19.058 1.00 0.00 H new ATOM 0 HB3 PHE A 83 17.899 -4.350 -18.565 1.00 0.00 H new ATOM 0 HD1 PHE A 83 16.515 -6.339 -17.293 1.00 0.00 H new ATOM 0 HD2 PHE A 83 16.364 -2.158 -16.324 1.00 0.00 H new ATOM 0 HE1 PHE A 83 15.947 -6.908 -14.949 1.00 0.00 H new ATOM 0 HE2 PHE A 83 15.748 -2.729 -13.989 1.00 0.00 H new ATOM 0 HZ PHE A 83 15.578 -5.100 -13.291 1.00 0.00 H new ATOM 1376 N GLY A 84 17.097 -2.302 -21.215 1.00 0.00 N ATOM 1377 CA GLY A 84 17.778 -2.121 -22.482 1.00 0.00 C ATOM 1378 C GLY A 84 18.360 -0.715 -22.584 1.00 0.00 C ATOM 1379 O GLY A 84 19.479 -0.536 -23.063 1.00 0.00 O ATOM 0 H GLY A 84 16.095 -2.477 -21.288 1.00 0.00 H new ATOM 0 HA2 GLY A 84 18.575 -2.858 -22.581 1.00 0.00 H new ATOM 0 HA3 GLY A 84 17.082 -2.292 -23.303 1.00 0.00 H new ATOM 1383 N LYS A 85 17.600 0.286 -22.132 1.00 0.00 N ATOM 1384 CA LYS A 85 17.978 1.681 -22.253 1.00 0.00 C ATOM 1385 C LYS A 85 19.271 1.995 -21.502 1.00 0.00 C ATOM 1386 O LYS A 85 20.021 2.877 -21.917 1.00 0.00 O ATOM 1387 CB LYS A 85 16.798 2.544 -21.798 1.00 0.00 C ATOM 1388 CG LYS A 85 16.798 2.829 -20.303 1.00 0.00 C ATOM 1389 CD LYS A 85 15.663 3.774 -19.901 1.00 0.00 C ATOM 1390 CE LYS A 85 14.297 3.233 -20.316 1.00 0.00 C ATOM 1391 NZ LYS A 85 13.915 3.644 -21.681 1.00 0.00 N1+ ATOM 0 H LYS A 85 16.702 0.142 -21.671 1.00 0.00 H new ATOM 0 HA LYS A 85 18.199 1.911 -23.295 1.00 0.00 H new ATOM 0 HB2 LYS A 85 16.818 3.489 -22.340 1.00 0.00 H new ATOM 0 HB3 LYS A 85 15.867 2.043 -22.065 1.00 0.00 H new ATOM 0 HG2 LYS A 85 16.701 1.892 -19.755 1.00 0.00 H new ATOM 0 HG3 LYS A 85 17.754 3.268 -20.017 1.00 0.00 H new ATOM 0 HD2 LYS A 85 15.681 3.924 -18.822 1.00 0.00 H new ATOM 0 HD3 LYS A 85 15.822 4.749 -20.361 1.00 0.00 H new ATOM 0 HE2 LYS A 85 14.308 2.145 -20.258 1.00 0.00 H new ATOM 0 HE3 LYS A 85 13.543 3.582 -19.611 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 12.884 3.768 -21.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 14.383 4.542 -21.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 14.209 2.912 -22.359 1.00 0.00 H new ATOM 1405 N VAL A 86 19.530 1.279 -20.406 1.00 0.00 N ATOM 1406 CA VAL A 86 20.739 1.457 -19.607 1.00 0.00 C ATOM 1407 C VAL A 86 21.826 0.449 -19.993 1.00 0.00 C ATOM 1408 O VAL A 86 22.993 0.644 -19.660 1.00 0.00 O ATOM 1409 CB VAL A 86 20.385 1.344 -18.116 1.00 0.00 C ATOM 1410 CG1 VAL A 86 19.352 2.401 -17.725 1.00 0.00 C ATOM 1411 CG2 VAL A 86 19.812 -0.029 -17.781 1.00 0.00 C ATOM 0 H VAL A 86 18.904 0.558 -20.048 1.00 0.00 H new ATOM 0 HA VAL A 86 21.144 2.449 -19.806 1.00 0.00 H new ATOM 0 HB VAL A 86 21.309 1.496 -17.559 1.00 0.00 H new ATOM 0 HG11 VAL A 86 19.115 2.304 -16.666 1.00 0.00 H new ATOM 0 HG12 VAL A 86 19.758 3.394 -17.916 1.00 0.00 H new ATOM 0 HG13 VAL A 86 18.446 2.259 -18.314 1.00 0.00 H new ATOM 0 HG21 VAL A 86 19.573 -0.074 -16.719 1.00 0.00 H new ATOM 0 HG22 VAL A 86 18.907 -0.198 -18.364 1.00 0.00 H new ATOM 0 HG23 VAL A 86 20.546 -0.798 -18.020 1.00 0.00 H new ATOM 1421 N ALA A 87 21.451 -0.627 -20.694 1.00 0.00 N ATOM 1422 CA ALA A 87 22.344 -1.724 -21.025 1.00 0.00 C ATOM 1423 C ALA A 87 23.602 -1.292 -21.775 1.00 0.00 C ATOM 1424 O ALA A 87 24.641 -1.922 -21.599 1.00 0.00 O ATOM 1425 CB ALA A 87 21.566 -2.728 -21.875 1.00 0.00 C ATOM 0 H ALA A 87 20.503 -0.754 -21.049 1.00 0.00 H new ATOM 0 HA ALA A 87 22.687 -2.160 -20.087 1.00 0.00 H new ATOM 0 HB1 ALA A 87 22.216 -3.563 -22.137 1.00 0.00 H new ATOM 0 HB2 ALA A 87 20.710 -3.097 -21.310 1.00 0.00 H new ATOM 0 HB3 ALA A 87 21.216 -2.240 -22.785 1.00 0.00 H new ATOM 1431 N ALA A 88 23.542 -0.241 -22.601 1.00 0.00 N ATOM 1432 CA ALA A 88 24.708 0.188 -23.351 1.00 0.00 C ATOM 1433 C ALA A 88 25.872 0.542 -22.426 1.00 0.00 C ATOM 1434 O ALA A 88 26.943 -0.053 -22.531 1.00 0.00 O ATOM 1435 CB ALA A 88 24.314 1.355 -24.250 1.00 0.00 C ATOM 0 H ALA A 88 22.703 0.317 -22.760 1.00 0.00 H new ATOM 0 HA ALA A 88 25.060 -0.634 -23.975 1.00 0.00 H new ATOM 0 HB1 ALA A 88 25.183 1.686 -24.819 1.00 0.00 H new ATOM 0 HB2 ALA A 88 23.530 1.036 -24.937 1.00 0.00 H new ATOM 0 HB3 ALA A 88 23.946 2.178 -23.637 1.00 0.00 H new ATOM 1441 N GLU A 89 25.676 1.504 -21.519 1.00 0.00 N ATOM 1442 CA GLU A 89 26.719 1.874 -20.578 1.00 0.00 C ATOM 1443 C GLU A 89 26.988 0.723 -19.615 1.00 0.00 C ATOM 1444 O GLU A 89 28.144 0.399 -19.349 1.00 0.00 O ATOM 1445 CB GLU A 89 26.300 3.122 -19.794 1.00 0.00 C ATOM 1446 CG GLU A 89 27.220 3.330 -18.585 1.00 0.00 C ATOM 1447 CD GLU A 89 26.984 4.679 -17.908 1.00 0.00 C ATOM 1448 OE1 GLU A 89 27.871 5.079 -17.121 1.00 0.00 O ATOM 1449 OE2 GLU A 89 25.927 5.289 -18.183 1.00 0.00 O1- ATOM 0 H GLU A 89 24.809 2.033 -21.422 1.00 0.00 H new ATOM 0 HA GLU A 89 27.631 2.092 -21.133 1.00 0.00 H new ATOM 0 HB2 GLU A 89 26.339 3.997 -20.443 1.00 0.00 H new ATOM 0 HB3 GLU A 89 25.268 3.019 -19.460 1.00 0.00 H new ATOM 0 HG2 GLU A 89 27.056 2.529 -17.864 1.00 0.00 H new ATOM 0 HG3 GLU A 89 28.260 3.263 -18.905 1.00 0.00 H new ATOM 1456 N VAL A 90 25.920 0.110 -19.099 1.00 0.00 N ATOM 1457 CA VAL A 90 26.026 -0.947 -18.108 1.00 0.00 C ATOM 1458 C VAL A 90 26.837 -2.127 -18.626 1.00 0.00 C ATOM 1459 O VAL A 90 27.911 -2.407 -18.099 1.00 0.00 O ATOM 1460 CB VAL A 90 24.633 -1.380 -17.654 1.00 0.00 C ATOM 1461 CG1 VAL A 90 24.739 -2.640 -16.797 1.00 0.00 C ATOM 1462 CG2 VAL A 90 23.993 -0.281 -16.810 1.00 0.00 C ATOM 0 H VAL A 90 24.961 0.337 -19.361 1.00 0.00 H new ATOM 0 HA VAL A 90 26.564 -0.554 -17.245 1.00 0.00 H new ATOM 0 HB VAL A 90 24.025 -1.573 -18.538 1.00 0.00 H new ATOM 0 HG11 VAL A 90 23.744 -2.946 -16.475 1.00 0.00 H new ATOM 0 HG12 VAL A 90 25.193 -3.440 -17.381 1.00 0.00 H new ATOM 0 HG13 VAL A 90 25.356 -2.434 -15.922 1.00 0.00 H new ATOM 0 HG21 VAL A 90 23.000 -0.599 -16.491 1.00 0.00 H new ATOM 0 HG22 VAL A 90 24.612 -0.089 -15.933 1.00 0.00 H new ATOM 0 HG23 VAL A 90 23.909 0.630 -17.402 1.00 0.00 H new ATOM 1472 N LEU A 91 26.346 -2.828 -19.650 1.00 0.00 N ATOM 1473 CA LEU A 91 27.030 -4.008 -20.157 1.00 0.00 C ATOM 1474 C LEU A 91 28.399 -3.621 -20.694 1.00 0.00 C ATOM 1475 O LEU A 91 29.341 -4.409 -20.620 1.00 0.00 O ATOM 1476 CB LEU A 91 26.192 -4.662 -21.251 1.00 0.00 C ATOM 1477 CG LEU A 91 24.795 -5.037 -20.748 1.00 0.00 C ATOM 1478 CD1 LEU A 91 23.990 -5.639 -21.899 1.00 0.00 C ATOM 1479 CD2 LEU A 91 24.834 -6.038 -19.602 1.00 0.00 C ATOM 0 H LEU A 91 25.481 -2.597 -20.139 1.00 0.00 H new ATOM 0 HA LEU A 91 27.164 -4.724 -19.346 1.00 0.00 H new ATOM 0 HB2 LEU A 91 26.103 -3.981 -22.097 1.00 0.00 H new ATOM 0 HB3 LEU A 91 26.700 -5.556 -21.613 1.00 0.00 H new ATOM 0 HG LEU A 91 24.330 -4.124 -20.376 1.00 0.00 H new ATOM 0 HD11 LEU A 91 22.995 -5.908 -21.545 1.00 0.00 H new ATOM 0 HD12 LEU A 91 23.904 -4.909 -22.704 1.00 0.00 H new ATOM 0 HD13 LEU A 91 24.496 -6.530 -22.270 1.00 0.00 H new ATOM 0 HD21 LEU A 91 23.817 -6.268 -19.285 1.00 0.00 H new ATOM 0 HD22 LEU A 91 25.326 -6.952 -19.934 1.00 0.00 H new ATOM 0 HD23 LEU A 91 25.387 -5.612 -18.765 1.00 0.00 H new ATOM 1491 N GLY A 92 28.509 -2.404 -21.233 1.00 0.00 N ATOM 1492 CA GLY A 92 29.788 -1.878 -21.663 1.00 0.00 C ATOM 1493 C GLY A 92 30.760 -1.857 -20.493 1.00 0.00 C ATOM 1494 O GLY A 92 31.901 -2.278 -20.651 1.00 0.00 O ATOM 0 H GLY A 92 27.722 -1.771 -21.378 1.00 0.00 H new ATOM 0 HA2 GLY A 92 30.190 -2.491 -22.470 1.00 0.00 H new ATOM 0 HA3 GLY A 92 29.662 -0.871 -22.060 1.00 0.00 H new ATOM 1498 N ARG A 93 30.311 -1.369 -19.326 1.00 0.00 N ATOM 1499 CA ARG A 93 31.092 -1.340 -18.098 1.00 0.00 C ATOM 1500 C ARG A 93 31.431 -2.734 -17.579 1.00 0.00 C ATOM 1501 O ARG A 93 32.530 -2.927 -17.068 1.00 0.00 O ATOM 1502 CB ARG A 93 30.288 -0.571 -17.051 1.00 0.00 C ATOM 1503 CG ARG A 93 30.682 0.903 -17.061 1.00 0.00 C ATOM 1504 CD ARG A 93 31.956 1.144 -16.241 1.00 0.00 C ATOM 1505 NE ARG A 93 31.740 0.881 -14.807 1.00 0.00 N ATOM 1506 CZ ARG A 93 32.080 -0.247 -14.166 1.00 0.00 C ATOM 1507 NH1 ARG A 93 32.675 -1.260 -14.797 1.00 0.00 N1+ ATOM 1508 NH2 ARG A 93 31.827 -0.388 -12.861 1.00 0.00 N ATOM 0 H ARG A 93 29.375 -0.978 -19.217 1.00 0.00 H new ATOM 0 HA ARG A 93 32.045 -0.852 -18.304 1.00 0.00 H new ATOM 0 HB2 ARG A 93 29.222 -0.671 -17.255 1.00 0.00 H new ATOM 0 HB3 ARG A 93 30.465 -0.995 -16.063 1.00 0.00 H new ATOM 0 HG2 ARG A 93 30.840 1.233 -18.088 1.00 0.00 H new ATOM 0 HG3 ARG A 93 29.867 1.502 -16.656 1.00 0.00 H new ATOM 0 HD2 ARG A 93 32.755 0.502 -16.612 1.00 0.00 H new ATOM 0 HD3 ARG A 93 32.286 2.174 -16.376 1.00 0.00 H new ATOM 0 HE ARG A 93 31.296 1.617 -14.257 1.00 0.00 H new ATOM 0 HH11 ARG A 93 32.883 -1.189 -15.793 1.00 0.00 H new ATOM 0 HH12 ARG A 93 32.922 -2.106 -14.284 1.00 0.00 H new ATOM 0 HH21 ARG A 93 31.372 0.365 -12.345 1.00 0.00 H new ATOM 0 HH22 ARG A 93 32.089 -1.249 -12.381 1.00 0.00 H new ATOM 1522 N ILE A 94 30.516 -3.704 -17.699 1.00 0.00 N ATOM 1523 CA ILE A 94 30.784 -5.060 -17.239 1.00 0.00 C ATOM 1524 C ILE A 94 31.997 -5.614 -17.972 1.00 0.00 C ATOM 1525 O ILE A 94 32.846 -6.279 -17.378 1.00 0.00 O ATOM 1526 CB ILE A 94 29.572 -5.959 -17.477 1.00 0.00 C ATOM 1527 CG1 ILE A 94 28.341 -5.394 -16.775 1.00 0.00 C ATOM 1528 CG2 ILE A 94 29.848 -7.354 -16.915 1.00 0.00 C ATOM 1529 CD1 ILE A 94 27.134 -6.294 -17.022 1.00 0.00 C ATOM 0 H ILE A 94 29.591 -3.570 -18.109 1.00 0.00 H new ATOM 0 HA ILE A 94 30.986 -5.036 -16.168 1.00 0.00 H new ATOM 0 HB ILE A 94 29.390 -6.010 -18.550 1.00 0.00 H new ATOM 0 HG12 ILE A 94 28.530 -5.312 -15.705 1.00 0.00 H new ATOM 0 HG13 ILE A 94 28.135 -4.388 -17.140 1.00 0.00 H new ATOM 0 HG21 ILE A 94 28.982 -7.993 -17.086 1.00 0.00 H new ATOM 0 HG22 ILE A 94 30.718 -7.781 -17.413 1.00 0.00 H new ATOM 0 HG23 ILE A 94 30.041 -7.283 -15.845 1.00 0.00 H new ATOM 0 HD11 ILE A 94 26.262 -5.880 -16.516 1.00 0.00 H new ATOM 0 HD12 ILE A 94 26.938 -6.354 -18.093 1.00 0.00 H new ATOM 0 HD13 ILE A 94 27.339 -7.292 -16.634 1.00 0.00 H new ATOM 1541 N ASN A 95 32.075 -5.337 -19.276 1.00 0.00 N ATOM 1542 CA ASN A 95 33.203 -5.762 -20.088 1.00 0.00 C ATOM 1543 C ASN A 95 34.517 -5.146 -19.603 1.00 0.00 C ATOM 1544 O ASN A 95 35.584 -5.603 -20.009 1.00 0.00 O ATOM 1545 CB ASN A 95 32.978 -5.334 -21.544 1.00 0.00 C ATOM 1546 CG ASN A 95 32.530 -6.462 -22.454 1.00 0.00 C ATOM 1547 OD1 ASN A 95 32.207 -7.558 -22.013 1.00 0.00 O ATOM 1548 ND2 ASN A 95 32.514 -6.184 -23.754 1.00 0.00 N ATOM 0 H ASN A 95 31.363 -4.817 -19.788 1.00 0.00 H new ATOM 0 HA ASN A 95 33.274 -6.847 -20.006 1.00 0.00 H new ATOM 0 HB2 ASN A 95 32.230 -4.542 -21.568 1.00 0.00 H new ATOM 0 HB3 ASN A 95 33.903 -4.910 -21.935 1.00 0.00 H new ATOM 0 HD21 ASN A 95 32.225 -6.896 -24.424 1.00 0.00 H new ATOM 0 HD22 ASN A 95 32.791 -5.258 -24.081 1.00 0.00 H new ATOM 1555 N GLN A 96 34.466 -4.122 -18.746 1.00 0.00 N ATOM 1556 CA GLN A 96 35.675 -3.432 -18.305 1.00 0.00 C ATOM 1557 C GLN A 96 36.181 -3.981 -16.979 1.00 0.00 C ATOM 1558 O GLN A 96 37.249 -3.583 -16.517 1.00 0.00 O ATOM 1559 CB GLN A 96 35.421 -1.929 -18.208 1.00 0.00 C ATOM 1560 CG GLN A 96 34.742 -1.446 -19.483 1.00 0.00 C ATOM 1561 CD GLN A 96 34.470 0.049 -19.476 1.00 0.00 C ATOM 1562 OE1 GLN A 96 35.006 0.792 -18.661 1.00 0.00 O ATOM 1563 NE2 GLN A 96 33.624 0.501 -20.398 1.00 0.00 N ATOM 0 H GLN A 96 33.602 -3.756 -18.347 1.00 0.00 H new ATOM 0 HA GLN A 96 36.452 -3.609 -19.048 1.00 0.00 H new ATOM 0 HB2 GLN A 96 34.794 -1.710 -17.344 1.00 0.00 H new ATOM 0 HB3 GLN A 96 36.362 -1.399 -18.061 1.00 0.00 H new ATOM 0 HG2 GLN A 96 35.370 -1.692 -20.339 1.00 0.00 H new ATOM 0 HG3 GLN A 96 33.801 -1.981 -19.613 1.00 0.00 H new ATOM 0 HE21 GLN A 96 33.197 -0.147 -21.060 1.00 0.00 H new ATOM 0 HE22 GLN A 96 33.402 1.496 -20.443 1.00 0.00 H new ATOM 1572 N GLU A 97 35.420 -4.890 -16.366 1.00 0.00 N ATOM 1573 CA GLU A 97 35.821 -5.513 -15.117 1.00 0.00 C ATOM 1574 C GLU A 97 35.703 -7.036 -15.168 1.00 0.00 C ATOM 1575 O GLU A 97 36.185 -7.715 -14.263 1.00 0.00 O ATOM 1576 CB GLU A 97 35.014 -4.884 -13.981 1.00 0.00 C ATOM 1577 CG GLU A 97 33.529 -5.241 -14.045 1.00 0.00 C ATOM 1578 CD GLU A 97 32.758 -4.491 -12.963 1.00 0.00 C ATOM 1579 OE1 GLU A 97 32.203 -5.178 -12.077 1.00 0.00 O ATOM 1580 OE2 GLU A 97 32.728 -3.239 -13.033 1.00 0.00 O1- ATOM 0 H GLU A 97 34.519 -5.208 -16.722 1.00 0.00 H new ATOM 0 HA GLU A 97 36.879 -5.326 -14.936 1.00 0.00 H new ATOM 0 HB2 GLU A 97 35.422 -5.213 -13.025 1.00 0.00 H new ATOM 0 HB3 GLU A 97 35.125 -3.800 -14.019 1.00 0.00 H new ATOM 0 HG2 GLU A 97 33.129 -4.989 -15.027 1.00 0.00 H new ATOM 0 HG3 GLU A 97 33.400 -6.315 -13.915 1.00 0.00 H new ATOM 1587 N PHE A 98 35.069 -7.583 -16.210 1.00 0.00 N ATOM 1588 CA PHE A 98 35.019 -9.022 -16.405 1.00 0.00 C ATOM 1589 C PHE A 98 36.328 -9.520 -17.009 1.00 0.00 C ATOM 1590 O PHE A 98 36.938 -8.833 -17.828 1.00 0.00 O ATOM 1591 CB PHE A 98 33.859 -9.411 -17.325 1.00 0.00 C ATOM 1592 CG PHE A 98 32.527 -9.638 -16.642 1.00 0.00 C ATOM 1593 CD1 PHE A 98 32.307 -9.204 -15.327 1.00 0.00 C ATOM 1594 CD2 PHE A 98 31.503 -10.301 -17.335 1.00 0.00 C ATOM 1595 CE1 PHE A 98 31.080 -9.456 -14.705 1.00 0.00 C ATOM 1596 CE2 PHE A 98 30.275 -10.553 -16.713 1.00 0.00 C ATOM 1597 CZ PHE A 98 30.066 -10.132 -15.394 1.00 0.00 C ATOM 0 H PHE A 98 34.585 -7.044 -16.928 1.00 0.00 H new ATOM 0 HA PHE A 98 34.867 -9.485 -15.430 1.00 0.00 H new ATOM 0 HB2 PHE A 98 33.734 -8.628 -18.073 1.00 0.00 H new ATOM 0 HB3 PHE A 98 34.132 -10.321 -17.859 1.00 0.00 H new ATOM 0 HD1 PHE A 98 33.084 -8.676 -14.795 1.00 0.00 H new ATOM 0 HD2 PHE A 98 31.663 -10.619 -18.355 1.00 0.00 H new ATOM 0 HE1 PHE A 98 30.914 -9.128 -13.689 1.00 0.00 H new ATOM 0 HE2 PHE A 98 29.492 -11.070 -17.248 1.00 0.00 H new ATOM 0 HZ PHE A 98 29.122 -10.329 -14.908 1.00 0.00 H new ATOM 1607 N PRO A 99 36.768 -10.719 -16.611 1.00 0.00 N ATOM 1608 CA PRO A 99 37.866 -11.421 -17.243 1.00 0.00 C ATOM 1609 C PRO A 99 37.386 -11.903 -18.601 1.00 0.00 C ATOM 1610 O PRO A 99 36.186 -12.001 -18.848 1.00 0.00 O ATOM 1611 CB PRO A 99 38.185 -12.593 -16.316 1.00 0.00 C ATOM 1612 CG PRO A 99 36.817 -12.899 -15.714 1.00 0.00 C ATOM 1613 CD PRO A 99 36.223 -11.506 -15.525 1.00 0.00 C ATOM 0 HA PRO A 99 38.753 -10.806 -17.396 1.00 0.00 H new ATOM 0 HB2 PRO A 99 38.592 -13.445 -16.860 1.00 0.00 H new ATOM 0 HB3 PRO A 99 38.916 -12.324 -15.554 1.00 0.00 H new ATOM 0 HG2 PRO A 99 36.209 -13.513 -16.378 1.00 0.00 H new ATOM 0 HG3 PRO A 99 36.900 -13.437 -14.770 1.00 0.00 H new ATOM 0 HD2 PRO A 99 35.134 -11.532 -15.564 1.00 0.00 H new ATOM 0 HD3 PRO A 99 36.498 -11.087 -14.557 1.00 0.00 H new ATOM 1621 N ARG A 100 38.331 -12.206 -19.488 1.00 0.00 N ATOM 1622 CA ARG A 100 38.025 -12.525 -20.870 1.00 0.00 C ATOM 1623 C ARG A 100 37.026 -13.666 -20.969 1.00 0.00 C ATOM 1624 O ARG A 100 36.188 -13.681 -21.869 1.00 0.00 O ATOM 1625 CB ARG A 100 39.327 -12.871 -21.585 1.00 0.00 C ATOM 1626 CG ARG A 100 40.190 -11.615 -21.691 1.00 0.00 C ATOM 1627 CD ARG A 100 41.065 -11.334 -20.464 1.00 0.00 C ATOM 1628 NE ARG A 100 41.947 -10.183 -20.709 1.00 0.00 N ATOM 1629 CZ ARG A 100 41.530 -8.913 -20.818 1.00 0.00 C ATOM 1630 NH1 ARG A 100 40.240 -8.600 -20.679 1.00 0.00 N1+ ATOM 1631 NH2 ARG A 100 42.407 -7.942 -21.072 1.00 0.00 N ATOM 0 H ARG A 100 39.326 -12.236 -19.265 1.00 0.00 H new ATOM 0 HA ARG A 100 37.561 -11.662 -21.347 1.00 0.00 H new ATOM 0 HB2 ARG A 100 39.861 -13.649 -21.038 1.00 0.00 H new ATOM 0 HB3 ARG A 100 39.116 -13.267 -22.578 1.00 0.00 H new ATOM 0 HG2 ARG A 100 40.833 -11.705 -22.566 1.00 0.00 H new ATOM 0 HG3 ARG A 100 39.540 -10.757 -21.861 1.00 0.00 H new ATOM 0 HD2 ARG A 100 40.433 -11.137 -19.598 1.00 0.00 H new ATOM 0 HD3 ARG A 100 41.664 -12.214 -20.228 1.00 0.00 H new ATOM 0 HE ARG A 100 42.947 -10.363 -20.803 1.00 0.00 H new ATOM 0 HH11 ARG A 100 39.556 -9.331 -20.487 1.00 0.00 H new ATOM 0 HH12 ARG A 100 39.939 -7.629 -20.765 1.00 0.00 H new ATOM 0 HH21 ARG A 100 43.396 -8.165 -21.184 1.00 0.00 H new ATOM 0 HH22 ARG A 100 42.089 -6.976 -21.155 1.00 0.00 H new ATOM 1645 N ASP A 101 37.113 -14.621 -20.045 1.00 0.00 N ATOM 1646 CA ASP A 101 36.183 -15.740 -20.059 1.00 0.00 C ATOM 1647 C ASP A 101 34.754 -15.303 -19.737 1.00 0.00 C ATOM 1648 O ASP A 101 33.816 -15.745 -20.402 1.00 0.00 O ATOM 1649 CB ASP A 101 36.635 -16.836 -19.097 1.00 0.00 C ATOM 1650 CG ASP A 101 36.001 -18.160 -19.508 1.00 0.00 C ATOM 1651 OD1 ASP A 101 36.079 -18.479 -20.716 1.00 0.00 O ATOM 1652 OD2 ASP A 101 35.447 -18.842 -18.619 1.00 0.00 O1- ATOM 0 H ASP A 101 37.803 -14.641 -19.294 1.00 0.00 H new ATOM 0 HA ASP A 101 36.183 -16.142 -21.072 1.00 0.00 H new ATOM 0 HB2 ASP A 101 37.722 -16.921 -19.109 1.00 0.00 H new ATOM 0 HB3 ASP A 101 36.346 -16.582 -18.077 1.00 0.00 H new ATOM 1657 N LEU A 102 34.568 -14.442 -18.729 1.00 0.00 N ATOM 1658 CA LEU A 102 33.239 -13.965 -18.381 1.00 0.00 C ATOM 1659 C LEU A 102 32.737 -12.983 -19.433 1.00 0.00 C ATOM 1660 O LEU A 102 31.536 -12.933 -19.696 1.00 0.00 O ATOM 1661 CB LEU A 102 33.236 -13.347 -16.980 1.00 0.00 C ATOM 1662 CG LEU A 102 33.524 -14.375 -15.881 1.00 0.00 C ATOM 1663 CD1 LEU A 102 33.339 -13.710 -14.517 1.00 0.00 C ATOM 1664 CD2 LEU A 102 32.571 -15.567 -15.957 1.00 0.00 C ATOM 0 H LEU A 102 35.319 -14.068 -18.149 1.00 0.00 H new ATOM 0 HA LEU A 102 32.553 -14.812 -18.364 1.00 0.00 H new ATOM 0 HB2 LEU A 102 33.983 -12.554 -16.935 1.00 0.00 H new ATOM 0 HB3 LEU A 102 32.267 -12.883 -16.794 1.00 0.00 H new ATOM 0 HG LEU A 102 34.545 -14.732 -16.018 1.00 0.00 H new ATOM 0 HD11 LEU A 102 33.542 -14.435 -13.728 1.00 0.00 H new ATOM 0 HD12 LEU A 102 34.028 -12.871 -14.425 1.00 0.00 H new ATOM 0 HD13 LEU A 102 32.314 -13.350 -14.424 1.00 0.00 H new ATOM 0 HD21 LEU A 102 32.808 -16.273 -15.161 1.00 0.00 H new ATOM 0 HD22 LEU A 102 31.544 -15.220 -15.841 1.00 0.00 H new ATOM 0 HD23 LEU A 102 32.680 -16.059 -16.923 1.00 0.00 H new ATOM 1676 N LYS A 103 33.642 -12.204 -20.041 1.00 0.00 N ATOM 1677 CA LYS A 103 33.278 -11.372 -21.181 1.00 0.00 C ATOM 1678 C LYS A 103 32.672 -12.215 -22.303 1.00 0.00 C ATOM 1679 O LYS A 103 31.750 -11.757 -22.976 1.00 0.00 O ATOM 1680 CB LYS A 103 34.496 -10.584 -21.674 1.00 0.00 C ATOM 1681 CG LYS A 103 34.893 -9.551 -20.616 1.00 0.00 C ATOM 1682 CD LYS A 103 36.106 -8.708 -21.005 1.00 0.00 C ATOM 1683 CE LYS A 103 35.826 -7.841 -22.228 1.00 0.00 C ATOM 1684 NZ LYS A 103 36.704 -6.657 -22.241 1.00 0.00 N1+ ATOM 0 H LYS A 103 34.621 -12.137 -19.761 1.00 0.00 H new ATOM 0 HA LYS A 103 32.518 -10.659 -20.860 1.00 0.00 H new ATOM 0 HB2 LYS A 103 35.328 -11.261 -21.867 1.00 0.00 H new ATOM 0 HB3 LYS A 103 34.265 -10.086 -22.616 1.00 0.00 H new ATOM 0 HG2 LYS A 103 34.046 -8.890 -20.431 1.00 0.00 H new ATOM 0 HG3 LYS A 103 35.105 -10.067 -19.679 1.00 0.00 H new ATOM 0 HD2 LYS A 103 36.391 -8.072 -20.167 1.00 0.00 H new ATOM 0 HD3 LYS A 103 36.953 -9.363 -21.210 1.00 0.00 H new ATOM 0 HE2 LYS A 103 35.980 -8.424 -23.136 1.00 0.00 H new ATOM 0 HE3 LYS A 103 34.783 -7.526 -22.225 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 36.645 -6.192 -23.169 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 36.401 -5.992 -21.501 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 37.686 -6.951 -22.062 1.00 0.00 H new ATOM 1698 N LYS A 104 33.166 -13.442 -22.523 1.00 0.00 N ATOM 1699 CA LYS A 104 32.546 -14.343 -23.489 1.00 0.00 C ATOM 1700 C LYS A 104 31.160 -14.773 -23.016 1.00 0.00 C ATOM 1701 O LYS A 104 30.246 -14.857 -23.836 1.00 0.00 O ATOM 1702 CB LYS A 104 33.416 -15.581 -23.717 1.00 0.00 C ATOM 1703 CG LYS A 104 34.704 -15.247 -24.470 1.00 0.00 C ATOM 1704 CD LYS A 104 35.543 -16.513 -24.671 1.00 0.00 C ATOM 1705 CE LYS A 104 35.978 -17.053 -23.310 1.00 0.00 C ATOM 1706 NZ LYS A 104 36.672 -18.347 -23.413 1.00 0.00 N1+ ATOM 0 H LYS A 104 33.984 -13.825 -22.048 1.00 0.00 H new ATOM 0 HA LYS A 104 32.448 -13.802 -24.430 1.00 0.00 H new ATOM 0 HB2 LYS A 104 33.665 -16.031 -22.756 1.00 0.00 H new ATOM 0 HB3 LYS A 104 32.850 -16.323 -24.280 1.00 0.00 H new ATOM 0 HG2 LYS A 104 34.464 -14.804 -25.436 1.00 0.00 H new ATOM 0 HG3 LYS A 104 35.278 -14.506 -23.913 1.00 0.00 H new ATOM 0 HD2 LYS A 104 34.963 -17.266 -25.205 1.00 0.00 H new ATOM 0 HD3 LYS A 104 36.417 -16.290 -25.283 1.00 0.00 H new ATOM 0 HE2 LYS A 104 36.635 -16.329 -22.829 1.00 0.00 H new ATOM 0 HE3 LYS A 104 35.103 -17.164 -22.670 1.00 0.00 H new ATOM 0 HZ1 LYS A 104 36.691 -18.806 -22.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 104 36.170 -18.957 -24.089 1.00 0.00 H new ATOM 0 HZ3 LYS A 104 37.646 -18.193 -23.743 1.00 0.00 H new ATOM 1720 N LYS A 105 30.983 -15.049 -21.717 1.00 0.00 N ATOM 1721 CA LYS A 105 29.662 -15.418 -21.208 1.00 0.00 C ATOM 1722 C LYS A 105 28.680 -14.276 -21.454 1.00 0.00 C ATOM 1723 O LYS A 105 27.574 -14.498 -21.951 1.00 0.00 O ATOM 1724 CB LYS A 105 29.705 -15.737 -19.707 1.00 0.00 C ATOM 1725 CG LYS A 105 30.778 -16.759 -19.326 1.00 0.00 C ATOM 1726 CD LYS A 105 30.646 -18.084 -20.073 1.00 0.00 C ATOM 1727 CE LYS A 105 31.755 -19.025 -19.595 1.00 0.00 C ATOM 1728 NZ LYS A 105 33.086 -18.516 -19.967 1.00 0.00 N1+ ATOM 0 H LYS A 105 31.723 -15.024 -21.015 1.00 0.00 H new ATOM 0 HA LYS A 105 29.337 -16.314 -21.738 1.00 0.00 H new ATOM 0 HB2 LYS A 105 29.881 -14.815 -19.153 1.00 0.00 H new ATOM 0 HB3 LYS A 105 28.730 -16.114 -19.397 1.00 0.00 H new ATOM 0 HG2 LYS A 105 31.762 -16.334 -19.526 1.00 0.00 H new ATOM 0 HG3 LYS A 105 30.725 -16.948 -18.254 1.00 0.00 H new ATOM 0 HD2 LYS A 105 29.668 -18.527 -19.888 1.00 0.00 H new ATOM 0 HD3 LYS A 105 30.724 -17.922 -21.148 1.00 0.00 H new ATOM 0 HE2 LYS A 105 31.696 -19.139 -18.513 1.00 0.00 H new ATOM 0 HE3 LYS A 105 31.607 -20.014 -20.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 33.481 -19.102 -20.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 33.003 -17.532 -20.294 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 33.716 -18.554 -19.140 1.00 0.00 H new ATOM 1742 N LEU A 106 29.091 -13.056 -21.104 1.00 0.00 N ATOM 1743 CA LEU A 106 28.293 -11.864 -21.329 1.00 0.00 C ATOM 1744 C LEU A 106 28.012 -11.692 -22.818 1.00 0.00 C ATOM 1745 O LEU A 106 26.904 -11.318 -23.199 1.00 0.00 O ATOM 1746 CB LEU A 106 29.041 -10.656 -20.759 1.00 0.00 C ATOM 1747 CG LEU A 106 28.432 -9.315 -21.186 1.00 0.00 C ATOM 1748 CD1 LEU A 106 26.985 -9.173 -20.726 1.00 0.00 C ATOM 1749 CD2 LEU A 106 29.237 -8.177 -20.563 1.00 0.00 C ATOM 0 H LEU A 106 29.989 -12.873 -20.656 1.00 0.00 H new ATOM 0 HA LEU A 106 27.332 -11.955 -20.823 1.00 0.00 H new ATOM 0 HB2 LEU A 106 29.042 -10.717 -19.671 1.00 0.00 H new ATOM 0 HB3 LEU A 106 30.081 -10.695 -21.082 1.00 0.00 H new ATOM 0 HG LEU A 106 28.459 -9.275 -22.275 1.00 0.00 H new ATOM 0 HD11 LEU A 106 26.593 -8.209 -21.050 1.00 0.00 H new ATOM 0 HD12 LEU A 106 26.385 -9.973 -21.160 1.00 0.00 H new ATOM 0 HD13 LEU A 106 26.941 -9.236 -19.639 1.00 0.00 H new ATOM 0 HD21 LEU A 106 28.808 -7.221 -20.863 1.00 0.00 H new ATOM 0 HD22 LEU A 106 29.207 -8.263 -19.477 1.00 0.00 H new ATOM 0 HD23 LEU A 106 30.271 -8.234 -20.903 1.00 0.00 H new ATOM 1761 N SER A 107 29.008 -11.961 -23.669 1.00 0.00 N ATOM 1762 CA SER A 107 28.830 -11.834 -25.105 1.00 0.00 C ATOM 1763 C SER A 107 27.697 -12.730 -25.601 1.00 0.00 C ATOM 1764 O SER A 107 26.864 -12.267 -26.378 1.00 0.00 O ATOM 1765 CB SER A 107 30.140 -12.160 -25.824 1.00 0.00 C ATOM 1766 OG SER A 107 29.949 -12.083 -27.220 1.00 0.00 O ATOM 0 H SER A 107 29.938 -12.266 -23.383 1.00 0.00 H new ATOM 0 HA SER A 107 28.555 -10.804 -25.330 1.00 0.00 H new ATOM 0 HB2 SER A 107 30.919 -11.463 -25.515 1.00 0.00 H new ATOM 0 HB3 SER A 107 30.479 -13.159 -25.548 1.00 0.00 H new ATOM 0 HG SER A 107 30.790 -12.291 -27.677 1.00 0.00 H new ATOM 1772 N ARG A 108 27.646 -13.999 -25.171 1.00 0.00 N ATOM 1773 CA ARG A 108 26.557 -14.873 -25.587 1.00 0.00 C ATOM 1774 C ARG A 108 25.222 -14.262 -25.180 1.00 0.00 C ATOM 1775 O ARG A 108 24.310 -14.188 -26.004 1.00 0.00 O ATOM 1776 CB ARG A 108 26.638 -16.252 -24.932 1.00 0.00 C ATOM 1777 CG ARG A 108 27.703 -17.162 -25.533 1.00 0.00 C ATOM 1778 CD ARG A 108 27.435 -18.593 -25.052 1.00 0.00 C ATOM 1779 NE ARG A 108 26.201 -19.130 -25.643 1.00 0.00 N ATOM 1780 CZ ARG A 108 25.263 -19.829 -24.987 1.00 0.00 C ATOM 1781 NH1 ARG A 108 25.391 -20.122 -23.692 1.00 0.00 N1+ ATOM 1782 NH2 ARG A 108 24.180 -20.239 -25.643 1.00 0.00 N ATOM 0 H ARG A 108 28.332 -14.429 -24.550 1.00 0.00 H new ATOM 0 HA ARG A 108 26.641 -14.982 -26.668 1.00 0.00 H new ATOM 0 HB2 ARG A 108 26.840 -16.126 -23.868 1.00 0.00 H new ATOM 0 HB3 ARG A 108 25.667 -16.741 -25.016 1.00 0.00 H new ATOM 0 HG2 ARG A 108 27.674 -17.115 -26.622 1.00 0.00 H new ATOM 0 HG3 ARG A 108 28.698 -16.838 -25.227 1.00 0.00 H new ATOM 0 HD2 ARG A 108 28.277 -19.232 -25.318 1.00 0.00 H new ATOM 0 HD3 ARG A 108 27.356 -18.605 -23.965 1.00 0.00 H new ATOM 0 HE ARG A 108 26.045 -18.956 -26.636 1.00 0.00 H new ATOM 0 HH11 ARG A 108 26.216 -19.813 -23.178 1.00 0.00 H new ATOM 0 HH12 ARG A 108 24.664 -20.655 -23.215 1.00 0.00 H new ATOM 0 HH21 ARG A 108 24.071 -20.021 -26.633 1.00 0.00 H new ATOM 0 HH22 ARG A 108 23.459 -20.771 -25.155 1.00 0.00 H new ATOM 1796 N VAL A 109 25.110 -13.829 -23.921 1.00 0.00 N ATOM 1797 CA VAL A 109 23.874 -13.239 -23.428 1.00 0.00 C ATOM 1798 C VAL A 109 23.490 -12.067 -24.318 1.00 0.00 C ATOM 1799 O VAL A 109 22.350 -11.976 -24.765 1.00 0.00 O ATOM 1800 CB VAL A 109 24.047 -12.804 -21.968 1.00 0.00 C ATOM 1801 CG1 VAL A 109 22.823 -12.023 -21.494 1.00 0.00 C ATOM 1802 CG2 VAL A 109 24.233 -14.035 -21.078 1.00 0.00 C ATOM 0 H VAL A 109 25.860 -13.878 -23.231 1.00 0.00 H new ATOM 0 HA VAL A 109 23.070 -13.974 -23.460 1.00 0.00 H new ATOM 0 HB VAL A 109 24.927 -12.164 -21.901 1.00 0.00 H new ATOM 0 HG11 VAL A 109 22.963 -11.722 -20.456 1.00 0.00 H new ATOM 0 HG12 VAL A 109 22.695 -11.136 -22.115 1.00 0.00 H new ATOM 0 HG13 VAL A 109 21.937 -12.653 -21.573 1.00 0.00 H new ATOM 0 HG21 VAL A 109 24.355 -13.720 -20.042 1.00 0.00 H new ATOM 0 HG22 VAL A 109 23.358 -14.679 -21.160 1.00 0.00 H new ATOM 0 HG23 VAL A 109 25.119 -14.584 -21.397 1.00 0.00 H new ATOM 1812 N VAL A 110 24.444 -11.171 -24.575 1.00 0.00 N ATOM 1813 CA VAL A 110 24.244 -10.006 -25.420 1.00 0.00 C ATOM 1814 C VAL A 110 23.794 -10.418 -26.820 1.00 0.00 C ATOM 1815 O VAL A 110 22.859 -9.829 -27.363 1.00 0.00 O ATOM 1816 CB VAL A 110 25.551 -9.204 -25.428 1.00 0.00 C ATOM 1817 CG1 VAL A 110 25.611 -8.188 -26.569 1.00 0.00 C ATOM 1818 CG2 VAL A 110 25.701 -8.458 -24.104 1.00 0.00 C ATOM 0 H VAL A 110 25.388 -11.240 -24.194 1.00 0.00 H new ATOM 0 HA VAL A 110 23.445 -9.376 -25.029 1.00 0.00 H new ATOM 0 HB VAL A 110 26.362 -9.918 -25.571 1.00 0.00 H new ATOM 0 HG11 VAL A 110 26.557 -7.649 -26.527 1.00 0.00 H new ATOM 0 HG12 VAL A 110 25.532 -8.708 -27.524 1.00 0.00 H new ATOM 0 HG13 VAL A 110 24.786 -7.482 -26.471 1.00 0.00 H new ATOM 0 HG21 VAL A 110 26.630 -7.888 -24.111 1.00 0.00 H new ATOM 0 HG22 VAL A 110 24.859 -7.778 -23.972 1.00 0.00 H new ATOM 0 HG23 VAL A 110 25.721 -9.175 -23.283 1.00 0.00 H new ATOM 1828 N ASN A 111 24.444 -11.420 -27.418 1.00 0.00 N ATOM 1829 CA ASN A 111 24.097 -11.877 -28.754 1.00 0.00 C ATOM 1830 C ASN A 111 22.669 -12.409 -28.815 1.00 0.00 C ATOM 1831 O ASN A 111 21.916 -12.070 -29.724 1.00 0.00 O ATOM 1832 CB ASN A 111 25.085 -12.943 -29.183 1.00 0.00 C ATOM 1833 CG ASN A 111 26.457 -12.335 -29.295 1.00 0.00 C ATOM 1834 OD1 ASN A 111 26.629 -11.160 -29.613 1.00 0.00 O ATOM 1835 ND2 ASN A 111 27.442 -13.165 -29.024 1.00 0.00 N ATOM 0 H ASN A 111 25.217 -11.929 -26.990 1.00 0.00 H new ATOM 0 HA ASN A 111 24.149 -11.030 -29.438 1.00 0.00 H new ATOM 0 HB2 ASN A 111 25.094 -13.758 -28.460 1.00 0.00 H new ATOM 0 HB3 ASN A 111 24.785 -13.369 -30.140 1.00 0.00 H new ATOM 0 HD21 ASN A 111 28.409 -12.843 -29.073 1.00 0.00 H new ATOM 0 HD22 ASN A 111 27.239 -14.130 -28.765 1.00 0.00 H new ATOM 1842 N ILE A 112 22.300 -13.243 -27.841 1.00 0.00 N ATOM 1843 CA ILE A 112 20.988 -13.865 -27.789 1.00 0.00 C ATOM 1844 C ILE A 112 19.895 -12.808 -27.655 1.00 0.00 C ATOM 1845 O ILE A 112 18.793 -12.987 -28.173 1.00 0.00 O ATOM 1846 CB ILE A 112 20.981 -14.846 -26.609 1.00 0.00 C ATOM 1847 CG1 ILE A 112 21.911 -16.022 -26.938 1.00 0.00 C ATOM 1848 CG2 ILE A 112 19.568 -15.354 -26.308 1.00 0.00 C ATOM 1849 CD1 ILE A 112 22.349 -16.736 -25.661 1.00 0.00 C ATOM 0 H ILE A 112 22.910 -13.503 -27.066 1.00 0.00 H new ATOM 0 HA ILE A 112 20.783 -14.406 -28.713 1.00 0.00 H new ATOM 0 HB ILE A 112 21.335 -14.327 -25.718 1.00 0.00 H new ATOM 0 HG12 ILE A 112 21.399 -16.724 -27.596 1.00 0.00 H new ATOM 0 HG13 ILE A 112 22.787 -15.660 -27.477 1.00 0.00 H new ATOM 0 HG21 ILE A 112 19.602 -16.046 -25.467 1.00 0.00 H new ATOM 0 HG22 ILE A 112 18.924 -14.511 -26.059 1.00 0.00 H new ATOM 0 HG23 ILE A 112 19.171 -15.867 -27.184 1.00 0.00 H new ATOM 0 HD11 ILE A 112 23.008 -17.566 -25.916 1.00 0.00 H new ATOM 0 HD12 ILE A 112 22.881 -16.036 -25.017 1.00 0.00 H new ATOM 0 HD13 ILE A 112 21.472 -17.116 -25.138 1.00 0.00 H new ATOM 1861 N LEU A 113 20.195 -11.707 -26.964 1.00 0.00 N ATOM 1862 CA LEU A 113 19.248 -10.618 -26.787 1.00 0.00 C ATOM 1863 C LEU A 113 18.973 -9.912 -28.110 1.00 0.00 C ATOM 1864 O LEU A 113 17.828 -9.577 -28.407 1.00 0.00 O ATOM 1865 CB LEU A 113 19.822 -9.638 -25.772 1.00 0.00 C ATOM 1866 CG LEU A 113 19.806 -10.226 -24.355 1.00 0.00 C ATOM 1867 CD1 LEU A 113 20.641 -9.360 -23.415 1.00 0.00 C ATOM 1868 CD2 LEU A 113 18.385 -10.320 -23.807 1.00 0.00 C ATOM 0 H LEU A 113 21.098 -11.551 -26.516 1.00 0.00 H new ATOM 0 HA LEU A 113 18.300 -11.018 -26.426 1.00 0.00 H new ATOM 0 HB2 LEU A 113 20.844 -9.382 -26.050 1.00 0.00 H new ATOM 0 HB3 LEU A 113 19.245 -8.713 -25.790 1.00 0.00 H new ATOM 0 HG LEU A 113 20.228 -11.229 -24.413 1.00 0.00 H new ATOM 0 HD11 LEU A 113 20.622 -9.788 -22.413 1.00 0.00 H new ATOM 0 HD12 LEU A 113 21.670 -9.322 -23.773 1.00 0.00 H new ATOM 0 HD13 LEU A 113 20.229 -8.351 -23.387 1.00 0.00 H new ATOM 0 HD21 LEU A 113 18.410 -10.741 -22.802 1.00 0.00 H new ATOM 0 HD22 LEU A 113 17.942 -9.325 -23.773 1.00 0.00 H new ATOM 0 HD23 LEU A 113 17.787 -10.962 -24.454 1.00 0.00 H new ATOM 1880 N LYS A 114 20.023 -9.685 -28.906 1.00 0.00 N ATOM 1881 CA LYS A 114 19.868 -9.128 -30.247 1.00 0.00 C ATOM 1882 C LYS A 114 18.982 -10.020 -31.106 1.00 0.00 C ATOM 1883 O LYS A 114 18.014 -9.549 -31.701 1.00 0.00 O ATOM 1884 CB LYS A 114 21.219 -9.021 -30.949 1.00 0.00 C ATOM 1885 CG LYS A 114 22.241 -8.204 -30.170 1.00 0.00 C ATOM 1886 CD LYS A 114 23.617 -8.444 -30.785 1.00 0.00 C ATOM 1887 CE LYS A 114 24.679 -8.046 -29.772 1.00 0.00 C ATOM 1888 NZ LYS A 114 26.023 -8.434 -30.232 1.00 0.00 N1+ ATOM 0 H LYS A 114 20.989 -9.880 -28.641 1.00 0.00 H new ATOM 0 HA LYS A 114 19.418 -8.142 -30.131 1.00 0.00 H new ATOM 0 HB2 LYS A 114 21.615 -10.023 -31.114 1.00 0.00 H new ATOM 0 HB3 LYS A 114 21.076 -8.569 -31.931 1.00 0.00 H new ATOM 0 HG2 LYS A 114 21.988 -7.144 -30.208 1.00 0.00 H new ATOM 0 HG3 LYS A 114 22.239 -8.495 -29.120 1.00 0.00 H new ATOM 0 HD2 LYS A 114 23.731 -9.493 -31.060 1.00 0.00 H new ATOM 0 HD3 LYS A 114 23.729 -7.861 -31.699 1.00 0.00 H new ATOM 0 HE2 LYS A 114 24.644 -6.969 -29.608 1.00 0.00 H new ATOM 0 HE3 LYS A 114 24.468 -8.521 -28.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 26.740 -7.926 -29.676 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 26.150 -9.459 -30.107 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 26.129 -8.192 -31.238 1.00 0.00 H new ATOM 1902 N GLU A 115 19.320 -11.314 -31.169 1.00 0.00 N ATOM 1903 CA GLU A 115 18.599 -12.272 -31.998 1.00 0.00 C ATOM 1904 C GLU A 115 17.127 -12.345 -31.605 1.00 0.00 C ATOM 1905 O GLU A 115 16.260 -12.447 -32.470 1.00 0.00 O ATOM 1906 CB GLU A 115 19.248 -13.653 -31.867 1.00 0.00 C ATOM 1907 CG GLU A 115 20.662 -13.680 -32.458 1.00 0.00 C ATOM 1908 CD GLU A 115 20.690 -13.255 -33.926 1.00 0.00 C ATOM 1909 OE1 GLU A 115 19.674 -13.496 -34.616 1.00 0.00 O ATOM 1910 OE2 GLU A 115 21.732 -12.696 -34.330 1.00 0.00 O1- ATOM 0 H GLU A 115 20.098 -11.719 -30.648 1.00 0.00 H new ATOM 0 HA GLU A 115 18.652 -11.940 -33.035 1.00 0.00 H new ATOM 0 HB2 GLU A 115 19.289 -13.936 -30.815 1.00 0.00 H new ATOM 0 HB3 GLU A 115 18.629 -14.394 -32.373 1.00 0.00 H new ATOM 0 HG2 GLU A 115 21.307 -13.019 -31.879 1.00 0.00 H new ATOM 0 HG3 GLU A 115 21.072 -14.686 -32.366 1.00 0.00 H new ATOM 1917 N ARG A 116 16.835 -12.292 -30.301 1.00 0.00 N ATOM 1918 CA ARG A 116 15.470 -12.326 -29.819 1.00 0.00 C ATOM 1919 C ARG A 116 14.834 -10.942 -29.854 1.00 0.00 C ATOM 1920 O ARG A 116 13.732 -10.772 -29.341 1.00 0.00 O ATOM 1921 CB ARG A 116 15.455 -12.961 -28.431 1.00 0.00 C ATOM 1922 CG ARG A 116 15.615 -14.470 -28.604 1.00 0.00 C ATOM 1923 CD ARG A 116 16.210 -15.129 -27.364 1.00 0.00 C ATOM 1924 NE ARG A 116 15.365 -14.893 -26.198 1.00 0.00 N ATOM 1925 CZ ARG A 116 14.767 -15.851 -25.480 1.00 0.00 C ATOM 1926 NH1 ARG A 116 14.974 -17.144 -25.725 1.00 0.00 N1+ ATOM 1927 NH2 ARG A 116 13.943 -15.517 -24.491 1.00 0.00 N ATOM 0 H ARG A 116 17.538 -12.225 -29.565 1.00 0.00 H new ATOM 0 HA ARG A 116 14.856 -12.940 -30.478 1.00 0.00 H new ATOM 0 HB2 ARG A 116 16.262 -12.559 -27.819 1.00 0.00 H new ATOM 0 HB3 ARG A 116 14.521 -12.733 -27.917 1.00 0.00 H new ATOM 0 HG2 ARG A 116 14.644 -14.915 -28.820 1.00 0.00 H new ATOM 0 HG3 ARG A 116 16.255 -14.670 -29.463 1.00 0.00 H new ATOM 0 HD2 ARG A 116 16.316 -16.201 -27.531 1.00 0.00 H new ATOM 0 HD3 ARG A 116 17.209 -14.735 -27.181 1.00 0.00 H new ATOM 0 HE ARG A 116 15.219 -13.926 -25.909 1.00 0.00 H new ATOM 0 HH11 ARG A 116 15.603 -17.426 -26.477 1.00 0.00 H new ATOM 0 HH12 ARG A 116 14.504 -17.852 -25.161 1.00 0.00 H new ATOM 0 HH21 ARG A 116 13.769 -14.534 -24.282 1.00 0.00 H new ATOM 0 HH22 ARG A 116 13.485 -16.244 -23.941 1.00 0.00 H new ATOM 1941 N ASN A 117 15.522 -9.961 -30.456 1.00 0.00 N ATOM 1942 CA ASN A 117 14.995 -8.625 -30.693 1.00 0.00 C ATOM 1943 C ASN A 117 14.320 -8.089 -29.436 1.00 0.00 C ATOM 1944 O ASN A 117 13.225 -7.531 -29.487 1.00 0.00 O ATOM 1945 CB ASN A 117 14.113 -8.610 -31.952 1.00 0.00 C ATOM 1946 CG ASN A 117 13.203 -9.817 -32.069 1.00 0.00 C ATOM 1947 OD1 ASN A 117 12.035 -9.783 -31.685 1.00 0.00 O ATOM 1948 ND2 ASN A 117 13.756 -10.897 -32.613 1.00 0.00 N ATOM 0 H ASN A 117 16.476 -10.084 -30.795 1.00 0.00 H new ATOM 0 HA ASN A 117 15.810 -7.932 -30.903 1.00 0.00 H new ATOM 0 HB2 ASN A 117 13.505 -7.706 -31.949 1.00 0.00 H new ATOM 0 HB3 ASN A 117 14.753 -8.561 -32.833 1.00 0.00 H new ATOM 0 HD21 ASN A 117 13.206 -11.749 -32.728 1.00 0.00 H new ATOM 0 HD22 ASN A 117 14.730 -10.874 -32.916 1.00 0.00 H new ATOM 1955 N ILE A 118 15.001 -8.272 -28.299 1.00 0.00 N ATOM 1956 CA ILE A 118 14.502 -7.855 -27.002 1.00 0.00 C ATOM 1957 C ILE A 118 14.492 -6.331 -26.910 1.00 0.00 C ATOM 1958 O ILE A 118 13.435 -5.723 -26.758 1.00 0.00 O ATOM 1959 CB ILE A 118 15.378 -8.486 -25.913 1.00 0.00 C ATOM 1960 CG1 ILE A 118 15.471 -10.012 -26.074 1.00 0.00 C ATOM 1961 CG2 ILE A 118 14.828 -8.115 -24.537 1.00 0.00 C ATOM 1962 CD1 ILE A 118 14.113 -10.709 -26.053 1.00 0.00 C ATOM 0 H ILE A 118 15.918 -8.717 -28.262 1.00 0.00 H new ATOM 0 HA ILE A 118 13.475 -8.193 -26.862 1.00 0.00 H new ATOM 0 HB ILE A 118 16.390 -8.093 -26.013 1.00 0.00 H new ATOM 0 HG12 ILE A 118 15.974 -10.241 -27.014 1.00 0.00 H new ATOM 0 HG13 ILE A 118 16.091 -10.417 -25.274 1.00 0.00 H new ATOM 0 HG21 ILE A 118 15.451 -8.564 -23.763 1.00 0.00 H new ATOM 0 HG22 ILE A 118 14.833 -7.031 -24.423 1.00 0.00 H new ATOM 0 HG23 ILE A 118 13.807 -8.485 -24.441 1.00 0.00 H new ATOM 0 HD11 ILE A 118 14.254 -11.783 -26.171 1.00 0.00 H new ATOM 0 HD12 ILE A 118 13.617 -10.511 -25.103 1.00 0.00 H new ATOM 0 HD13 ILE A 118 13.498 -10.331 -26.870 1.00 0.00 H new ATOM 1974 N PHE A 119 15.675 -5.716 -27.007 1.00 0.00 N ATOM 1975 CA PHE A 119 15.813 -4.270 -27.103 1.00 0.00 C ATOM 1976 C PHE A 119 15.522 -3.754 -28.511 1.00 0.00 C ATOM 1977 O PHE A 119 15.382 -4.529 -29.454 1.00 0.00 O ATOM 1978 CB PHE A 119 17.229 -3.876 -26.702 1.00 0.00 C ATOM 1979 CG PHE A 119 17.732 -4.656 -25.515 1.00 0.00 C ATOM 1980 CD1 PHE A 119 18.977 -5.290 -25.578 1.00 0.00 C ATOM 1981 CD2 PHE A 119 16.948 -4.751 -24.358 1.00 0.00 C ATOM 1982 CE1 PHE A 119 19.436 -6.030 -24.484 1.00 0.00 C ATOM 1983 CE2 PHE A 119 17.407 -5.492 -23.264 1.00 0.00 C ATOM 1984 CZ PHE A 119 18.654 -6.128 -23.324 1.00 0.00 C ATOM 0 H PHE A 119 16.565 -6.215 -27.021 1.00 0.00 H new ATOM 0 HA PHE A 119 15.082 -3.820 -26.431 1.00 0.00 H new ATOM 0 HB2 PHE A 119 17.899 -4.034 -27.547 1.00 0.00 H new ATOM 0 HB3 PHE A 119 17.254 -2.811 -26.470 1.00 0.00 H new ATOM 0 HD1 PHE A 119 19.582 -5.208 -26.469 1.00 0.00 H new ATOM 0 HD2 PHE A 119 15.991 -4.253 -24.311 1.00 0.00 H new ATOM 0 HE1 PHE A 119 20.394 -6.527 -24.532 1.00 0.00 H new ATOM 0 HE2 PHE A 119 16.801 -5.574 -22.374 1.00 0.00 H new ATOM 0 HZ PHE A 119 19.013 -6.694 -22.477 1.00 0.00 H new ATOM 1994 N SER A 120 15.436 -2.428 -28.645 1.00 0.00 N ATOM 1995 CA SER A 120 15.246 -1.774 -29.932 1.00 0.00 C ATOM 1996 C SER A 120 16.556 -1.771 -30.721 1.00 0.00 C ATOM 1997 O SER A 120 17.635 -1.858 -30.140 1.00 0.00 O ATOM 1998 CB SER A 120 14.764 -0.344 -29.710 1.00 0.00 C ATOM 1999 OG SER A 120 14.693 0.345 -30.940 1.00 0.00 O ATOM 0 H SER A 120 15.497 -1.781 -27.859 1.00 0.00 H new ATOM 0 HA SER A 120 14.497 -2.321 -30.505 1.00 0.00 H new ATOM 0 HB2 SER A 120 13.784 -0.353 -29.233 1.00 0.00 H new ATOM 0 HB3 SER A 120 15.443 0.175 -29.033 1.00 0.00 H new ATOM 0 HG SER A 120 14.381 1.261 -30.784 1.00 0.00 H new ATOM 2005 N LYS A 121 16.462 -1.668 -32.052 1.00 0.00 N ATOM 2006 CA LYS A 121 17.630 -1.648 -32.918 1.00 0.00 C ATOM 2007 C LYS A 121 18.592 -0.531 -32.520 1.00 0.00 C ATOM 2008 O LYS A 121 19.808 -0.691 -32.615 1.00 0.00 O ATOM 2009 CB LYS A 121 17.170 -1.494 -34.370 1.00 0.00 C ATOM 2010 CG LYS A 121 16.390 -0.200 -34.617 1.00 0.00 C ATOM 2011 CD LYS A 121 15.912 -0.155 -36.071 1.00 0.00 C ATOM 2012 CE LYS A 121 15.125 1.129 -36.321 1.00 0.00 C ATOM 2013 NZ LYS A 121 14.641 1.194 -37.710 1.00 0.00 N1+ ATOM 0 H LYS A 121 15.575 -1.597 -32.550 1.00 0.00 H new ATOM 0 HA LYS A 121 18.173 -2.587 -32.812 1.00 0.00 H new ATOM 0 HB2 LYS A 121 18.041 -1.518 -35.025 1.00 0.00 H new ATOM 0 HB3 LYS A 121 16.545 -2.345 -34.639 1.00 0.00 H new ATOM 0 HG2 LYS A 121 15.536 -0.144 -33.942 1.00 0.00 H new ATOM 0 HG3 LYS A 121 17.021 0.663 -34.405 1.00 0.00 H new ATOM 0 HD2 LYS A 121 16.767 -0.205 -36.745 1.00 0.00 H new ATOM 0 HD3 LYS A 121 15.287 -1.022 -36.284 1.00 0.00 H new ATOM 0 HE2 LYS A 121 14.279 1.180 -35.635 1.00 0.00 H new ATOM 0 HE3 LYS A 121 15.757 1.992 -36.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 14.110 2.077 -37.852 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 15.451 1.169 -38.361 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 14.020 0.382 -37.899 1.00 0.00 H new ATOM 2027 N GLN A 122 18.043 0.598 -32.072 1.00 0.00 N ATOM 2028 CA GLN A 122 18.834 1.718 -31.589 1.00 0.00 C ATOM 2029 C GLN A 122 19.654 1.291 -30.376 1.00 0.00 C ATOM 2030 O GLN A 122 20.868 1.480 -30.349 1.00 0.00 O ATOM 2031 CB GLN A 122 17.890 2.877 -31.248 1.00 0.00 C ATOM 2032 CG GLN A 122 18.552 3.940 -30.360 1.00 0.00 C ATOM 2033 CD GLN A 122 18.004 3.896 -28.937 1.00 0.00 C ATOM 2034 OE1 GLN A 122 16.795 3.818 -28.734 1.00 0.00 O ATOM 2035 NE2 GLN A 122 18.879 3.944 -27.934 1.00 0.00 N ATOM 0 H GLN A 122 17.036 0.757 -32.036 1.00 0.00 H new ATOM 0 HA GLN A 122 19.532 2.048 -32.358 1.00 0.00 H new ATOM 0 HB2 GLN A 122 17.546 3.344 -32.171 1.00 0.00 H new ATOM 0 HB3 GLN A 122 17.008 2.485 -30.742 1.00 0.00 H new ATOM 0 HG2 GLN A 122 19.630 3.781 -30.341 1.00 0.00 H new ATOM 0 HG3 GLN A 122 18.383 4.929 -30.786 1.00 0.00 H new ATOM 0 HE21 GLN A 122 19.878 4.009 -28.131 1.00 0.00 H new ATOM 0 HE22 GLN A 122 18.550 3.916 -26.969 1.00 0.00 H new ATOM 2044 N VAL A 123 18.982 0.714 -29.374 1.00 0.00 N ATOM 2045 CA VAL A 123 19.632 0.279 -28.150 1.00 0.00 C ATOM 2046 C VAL A 123 20.687 -0.779 -28.450 1.00 0.00 C ATOM 2047 O VAL A 123 21.747 -0.785 -27.826 1.00 0.00 O ATOM 2048 CB VAL A 123 18.570 -0.262 -27.188 1.00 0.00 C ATOM 2049 CG1 VAL A 123 19.219 -0.950 -25.991 1.00 0.00 C ATOM 2050 CG2 VAL A 123 17.697 0.886 -26.682 1.00 0.00 C ATOM 0 H VAL A 123 17.977 0.540 -29.396 1.00 0.00 H new ATOM 0 HA VAL A 123 20.139 1.124 -27.685 1.00 0.00 H new ATOM 0 HB VAL A 123 17.962 -0.987 -27.729 1.00 0.00 H new ATOM 0 HG11 VAL A 123 18.444 -1.325 -25.323 1.00 0.00 H new ATOM 0 HG12 VAL A 123 19.833 -1.781 -26.338 1.00 0.00 H new ATOM 0 HG13 VAL A 123 19.845 -0.236 -25.456 1.00 0.00 H new ATOM 0 HG21 VAL A 123 16.943 0.496 -25.998 1.00 0.00 H new ATOM 0 HG22 VAL A 123 18.319 1.613 -26.160 1.00 0.00 H new ATOM 0 HG23 VAL A 123 17.205 1.369 -27.527 1.00 0.00 H new ATOM 2060 N VAL A 124 20.414 -1.678 -29.400 1.00 0.00 N ATOM 2061 CA VAL A 124 21.382 -2.703 -29.760 1.00 0.00 C ATOM 2062 C VAL A 124 22.674 -2.073 -30.273 1.00 0.00 C ATOM 2063 O VAL A 124 23.755 -2.496 -29.870 1.00 0.00 O ATOM 2064 CB VAL A 124 20.781 -3.651 -30.805 1.00 0.00 C ATOM 2065 CG1 VAL A 124 21.859 -4.551 -31.413 1.00 0.00 C ATOM 2066 CG2 VAL A 124 19.733 -4.544 -30.139 1.00 0.00 C ATOM 0 H VAL A 124 19.540 -1.713 -29.925 1.00 0.00 H new ATOM 0 HA VAL A 124 21.626 -3.281 -28.868 1.00 0.00 H new ATOM 0 HB VAL A 124 20.331 -3.045 -31.592 1.00 0.00 H new ATOM 0 HG11 VAL A 124 21.406 -5.213 -32.151 1.00 0.00 H new ATOM 0 HG12 VAL A 124 22.618 -3.935 -31.896 1.00 0.00 H new ATOM 0 HG13 VAL A 124 22.322 -5.147 -30.626 1.00 0.00 H new ATOM 0 HG21 VAL A 124 19.305 -5.218 -30.881 1.00 0.00 H new ATOM 0 HG22 VAL A 124 20.202 -5.127 -29.347 1.00 0.00 H new ATOM 0 HG23 VAL A 124 18.944 -3.924 -29.714 1.00 0.00 H new ATOM 2076 N ASN A 125 22.589 -1.072 -31.156 1.00 0.00 N ATOM 2077 CA ASN A 125 23.785 -0.425 -31.684 1.00 0.00 C ATOM 2078 C ASN A 125 24.548 0.296 -30.573 1.00 0.00 C ATOM 2079 O ASN A 125 25.778 0.337 -30.604 1.00 0.00 O ATOM 2080 CB ASN A 125 23.397 0.542 -32.804 1.00 0.00 C ATOM 2081 CG ASN A 125 23.128 -0.198 -34.106 1.00 0.00 C ATOM 2082 OD1 ASN A 125 24.015 -0.321 -34.944 1.00 0.00 O ATOM 2083 ND2 ASN A 125 21.911 -0.698 -34.297 1.00 0.00 N ATOM 0 H ASN A 125 21.710 -0.698 -31.515 1.00 0.00 H new ATOM 0 HA ASN A 125 24.447 -1.187 -32.095 1.00 0.00 H new ATOM 0 HB2 ASN A 125 22.509 1.102 -32.512 1.00 0.00 H new ATOM 0 HB3 ASN A 125 24.197 1.267 -32.954 1.00 0.00 H new ATOM 0 HD21 ASN A 125 21.695 -1.200 -35.159 1.00 0.00 H new ATOM 0 HD22 ASN A 125 21.193 -0.580 -33.582 1.00 0.00 H new ATOM 2090 N ASP A 126 23.830 0.861 -29.599 1.00 0.00 N ATOM 2091 CA ASP A 126 24.445 1.481 -28.440 1.00 0.00 C ATOM 2092 C ASP A 126 25.223 0.450 -27.629 1.00 0.00 C ATOM 2093 O ASP A 126 26.365 0.699 -27.247 1.00 0.00 O ATOM 2094 CB ASP A 126 23.367 2.166 -27.590 1.00 0.00 C ATOM 2095 CG ASP A 126 22.614 3.261 -28.343 1.00 0.00 C ATOM 2096 OD1 ASP A 126 23.148 3.746 -29.368 1.00 0.00 O ATOM 2097 OD2 ASP A 126 21.505 3.601 -27.881 1.00 0.00 O1- ATOM 0 H ASP A 126 22.811 0.898 -29.598 1.00 0.00 H new ATOM 0 HA ASP A 126 25.156 2.238 -28.771 1.00 0.00 H new ATOM 0 HB2 ASP A 126 22.655 1.416 -27.244 1.00 0.00 H new ATOM 0 HB3 ASP A 126 23.832 2.597 -26.703 1.00 0.00 H new ATOM 2102 N ILE A 127 24.613 -0.708 -27.366 1.00 0.00 N ATOM 2103 CA ILE A 127 25.275 -1.793 -26.658 1.00 0.00 C ATOM 2104 C ILE A 127 26.476 -2.296 -27.456 1.00 0.00 C ATOM 2105 O ILE A 127 27.561 -2.458 -26.898 1.00 0.00 O ATOM 2106 CB ILE A 127 24.262 -2.919 -26.408 1.00 0.00 C ATOM 2107 CG1 ILE A 127 23.179 -2.436 -25.437 1.00 0.00 C ATOM 2108 CG2 ILE A 127 24.949 -4.157 -25.829 1.00 0.00 C ATOM 2109 CD1 ILE A 127 21.974 -3.371 -25.443 1.00 0.00 C ATOM 0 H ILE A 127 23.652 -0.914 -27.638 1.00 0.00 H new ATOM 0 HA ILE A 127 25.647 -1.434 -25.699 1.00 0.00 H new ATOM 0 HB ILE A 127 23.810 -3.188 -27.363 1.00 0.00 H new ATOM 0 HG12 ILE A 127 23.591 -2.376 -24.430 1.00 0.00 H new ATOM 0 HG13 ILE A 127 22.863 -1.430 -25.712 1.00 0.00 H new ATOM 0 HG21 ILE A 127 24.209 -4.939 -25.662 1.00 0.00 H new ATOM 0 HG22 ILE A 127 25.703 -4.515 -26.529 1.00 0.00 H new ATOM 0 HG23 ILE A 127 25.425 -3.900 -24.883 1.00 0.00 H new ATOM 0 HD11 ILE A 127 21.223 -3.002 -24.744 1.00 0.00 H new ATOM 0 HD12 ILE A 127 21.549 -3.410 -26.446 1.00 0.00 H new ATOM 0 HD13 ILE A 127 22.288 -4.371 -25.143 1.00 0.00 H new ATOM 2121 N GLU A 128 26.294 -2.544 -28.756 1.00 0.00 N ATOM 2122 CA GLU A 128 27.358 -3.078 -29.592 1.00 0.00 C ATOM 2123 C GLU A 128 28.585 -2.175 -29.571 1.00 0.00 C ATOM 2124 O GLU A 128 29.689 -2.653 -29.321 1.00 0.00 O ATOM 2125 CB GLU A 128 26.871 -3.244 -31.036 1.00 0.00 C ATOM 2126 CG GLU A 128 25.872 -4.392 -31.203 1.00 0.00 C ATOM 2127 CD GLU A 128 26.546 -5.761 -31.191 1.00 0.00 C ATOM 2128 OE1 GLU A 128 26.218 -6.565 -32.092 1.00 0.00 O ATOM 2129 OE2 GLU A 128 27.379 -6.004 -30.293 1.00 0.00 O1- ATOM 0 H GLU A 128 25.415 -2.381 -29.248 1.00 0.00 H new ATOM 0 HA GLU A 128 27.637 -4.051 -29.188 1.00 0.00 H new ATOM 0 HB2 GLU A 128 26.406 -2.315 -31.366 1.00 0.00 H new ATOM 0 HB3 GLU A 128 27.729 -3.419 -31.685 1.00 0.00 H new ATOM 0 HG2 GLU A 128 25.135 -4.347 -30.402 1.00 0.00 H new ATOM 0 HG3 GLU A 128 25.331 -4.265 -32.141 1.00 0.00 H new ATOM 2136 N ARG A 129 28.414 -0.873 -29.830 1.00 0.00 N ATOM 2137 CA ARG A 129 29.557 0.023 -29.887 1.00 0.00 C ATOM 2138 C ARG A 129 30.194 0.173 -28.508 1.00 0.00 C ATOM 2139 O ARG A 129 31.401 0.391 -28.409 1.00 0.00 O ATOM 2140 CB ARG A 129 29.123 1.363 -30.480 1.00 0.00 C ATOM 2141 CG ARG A 129 28.843 2.412 -29.401 1.00 0.00 C ATOM 2142 CD ARG A 129 28.411 3.719 -30.055 1.00 0.00 C ATOM 2143 NE ARG A 129 27.221 3.534 -30.896 1.00 0.00 N ATOM 2144 CZ ARG A 129 25.977 3.850 -30.527 1.00 0.00 C ATOM 2145 NH1 ARG A 129 25.726 4.434 -29.356 1.00 0.00 N1+ ATOM 2146 NH2 ARG A 129 24.951 3.583 -31.332 1.00 0.00 N ATOM 0 H ARG A 129 27.511 -0.430 -29.999 1.00 0.00 H new ATOM 0 HA ARG A 129 30.323 -0.398 -30.538 1.00 0.00 H new ATOM 0 HB2 ARG A 129 29.901 1.731 -31.148 1.00 0.00 H new ATOM 0 HB3 ARG A 129 28.227 1.218 -31.084 1.00 0.00 H new ATOM 0 HG2 ARG A 129 28.063 2.056 -28.728 1.00 0.00 H new ATOM 0 HG3 ARG A 129 29.736 2.574 -28.797 1.00 0.00 H new ATOM 0 HD2 ARG A 129 28.201 4.460 -29.284 1.00 0.00 H new ATOM 0 HD3 ARG A 129 29.228 4.111 -30.661 1.00 0.00 H new ATOM 0 HE ARG A 129 27.354 3.137 -31.826 1.00 0.00 H new ATOM 0 HH11 ARG A 129 26.493 4.649 -28.719 1.00 0.00 H new ATOM 0 HH12 ARG A 129 24.767 4.666 -29.097 1.00 0.00 H new ATOM 0 HH21 ARG A 129 25.114 3.136 -32.234 1.00 0.00 H new ATOM 0 HH22 ARG A 129 24.002 3.826 -31.047 1.00 0.00 H new ATOM 2160 N SER A 130 29.386 0.060 -27.448 1.00 0.00 N ATOM 2161 CA SER A 130 29.874 0.177 -26.086 1.00 0.00 C ATOM 2162 C SER A 130 30.782 -0.991 -25.729 1.00 0.00 C ATOM 2163 O SER A 130 31.914 -0.787 -25.299 1.00 0.00 O ATOM 2164 CB SER A 130 28.679 0.252 -25.141 1.00 0.00 C ATOM 2165 OG SER A 130 29.119 0.418 -23.816 1.00 0.00 O ATOM 0 H SER A 130 28.383 -0.114 -27.518 1.00 0.00 H new ATOM 0 HA SER A 130 30.469 1.085 -25.990 1.00 0.00 H new ATOM 0 HB2 SER A 130 28.033 1.083 -25.425 1.00 0.00 H new ATOM 0 HB3 SER A 130 28.083 -0.657 -25.223 1.00 0.00 H new ATOM 0 HG SER A 130 28.344 0.488 -23.220 1.00 0.00 H new ATOM 2171 N LEU A 131 30.297 -2.225 -25.903 1.00 0.00 N ATOM 2172 CA LEU A 131 31.116 -3.398 -25.670 1.00 0.00 C ATOM 2173 C LEU A 131 32.251 -3.471 -26.685 1.00 0.00 C ATOM 2174 O LEU A 131 33.299 -4.025 -26.364 1.00 0.00 O ATOM 2175 CB LEU A 131 30.262 -4.666 -25.725 1.00 0.00 C ATOM 2176 CG LEU A 131 29.473 -4.848 -24.423 1.00 0.00 C ATOM 2177 CD1 LEU A 131 28.220 -3.981 -24.377 1.00 0.00 C ATOM 2178 CD2 LEU A 131 29.049 -6.307 -24.278 1.00 0.00 C ATOM 0 H LEU A 131 29.343 -2.427 -26.204 1.00 0.00 H new ATOM 0 HA LEU A 131 31.553 -3.320 -24.675 1.00 0.00 H new ATOM 0 HB2 LEU A 131 29.573 -4.610 -26.568 1.00 0.00 H new ATOM 0 HB3 LEU A 131 30.901 -5.533 -25.893 1.00 0.00 H new ATOM 0 HG LEU A 131 30.131 -4.546 -23.608 1.00 0.00 H new ATOM 0 HD11 LEU A 131 27.697 -4.147 -23.435 1.00 0.00 H new ATOM 0 HD12 LEU A 131 28.501 -2.931 -24.456 1.00 0.00 H new ATOM 0 HD13 LEU A 131 27.565 -4.245 -25.207 1.00 0.00 H new ATOM 0 HD21 LEU A 131 28.489 -6.433 -23.352 1.00 0.00 H new ATOM 0 HD22 LEU A 131 28.421 -6.589 -25.123 1.00 0.00 H new ATOM 0 HD23 LEU A 131 29.934 -6.943 -24.256 1.00 0.00 H new